Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.47 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9269776 | 0.91 | ALDH1A1 (0.43) | PDK1VCAM1ALDH1A1HPGDNPSR1 | |
| SCHEMBL2061507 | 0.90 | PDK1 (0.46) | PDK1VCAM1ALDH1A1HPGDNPSR1 | |
| SCHEMBL31260597 | 0.90 | PDK1 (0.58) | PDK1VCAM1ALDH1A1HPGDNPSR1 | |
| SCHEMBL24211 | 0.90 | PDK1 (0.58) | PDK1VCAM1ALDH1A1HPGDNPSR1 | |
| SCHEMBL6953347 | 0.88 | PDK1 (0.46) | PDK1VCAM1ALDH1A1HPGDNPSR1 | |
| SCHEMBL27515403 | 0.86 | PDK1 (0.45) | PDK1VCAM1ALDH1A1HPGDNPSR1 | |
| SCHEMBL20621417 | 0.85 | PDK1 (0.40) | PDK1VCAM1ALDH1A1HPGDNPSR1 | |
| SCHEMBL7443550 | 0.85 | VCAM1 (0.46) | PDK1VCAM1ALDH1A1HPGDNPSR1 | |
| SCHEMBL3012634 | 0.85 | PDK1 (0.44) | PDK1VCAM1ALDH1A1HPGDNPSR1 | |
| SCHEMBL5957173 | 0.84 | PDGFRB (0.55) | PDK1VCAM1ALDH1A1HPGDNPSR1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5756810-A | Process of preparing 3-nitro benzoate compounds in lower alkanol | PHARMACOPEIA, INC. (US) | 1998-05-26 | — | — | US | claimed |
| EP-0751765-A4 | SULFONAMIDE DERIVATIVES AND THEIR USE | PHARMACOPEIA INC (US) | 1997-05-28 | — | — | EP | claimed |
| EP-0751765-A1 | SULFONAMIDE DERIVATIVES AND THEIR USE | PHARMACOPEIA, INC. (US) | 1997-01-08 | — | — | EP | claimed |
| WO-1995024186-A1 | SULFONAMIDE DERIVATIVES AND THEIR USE | PHARMACOPEIA, INC. (US) | 1995-09-14 | — | — | WO | claimed |
| US-20050202458-A1 | Antigen-specific cells, methods of generating these cells and uses thereof | ROBERTS BRUCE L (US) | 2005-09-15 | — | — | US | disclosed |
| US-6790965-B1 | INHIBITION OF CARBONIC ANHYDRASE ISOZYMES; GLAUCOMA | PHARMACOPEIA DRUG DISCOVERY, INC. | 2004-09-14 | — | — | US | disclosed |
| EP-0954601-A4 | A METHOD FOR IDENTIFYING CYTOTOXIC T-CELL EPITOPES | GENZYME CORP (US) | 2004-08-18 | — | — | EP | disclosed |
| EP-0751765-B1 | SULFONAMIDE DERIVATIVES AND THEIR USE | PHARMACOPEIA INC (US) | 2003-05-07 | — | — | EP | disclosed |
| EP-1051507-A4 | ANTIGEN-SPECIFIC CELLS, METHODS OF GENERATING THESE CELLS AND USES THEREOF | GENZYME CORP (US) | 2003-02-05 | — | — | EP | disclosed |
| US-20020172979-A1 | Method for identifying cytotoxic T-cell epitopes | NICOLETTE CHARLES A (US) | 2002-11-21 | — | — | US | disclosed |
| EP-0766826-B1 | SYNTHESIS OF COMBINATORIAL LIBRARIES | PHARMACOPEIA INC (US) | 2002-05-22 | — | — | EP | disclosed |
| US-6338945-B1 | CONCURRENT SCREENING OF OLIGOPEPTIDE LIBRARIES SYNTHESIZED ON SOLID PHASE SUPPORTS TO ISOLATE BIOACTIVE MOLECULES WHICH ELICIT CYTOLYTIC ACTIVITY | GENZYME CORPORATION | 2002-01-15 | — | — | US | disclosed |
| WO-1997016729-A1 | COMBINATORIAL DIHYDROBENZOPYRAN LIBRARY | PHARMACOPEIA, INC. (US) | 1997-05-09 | — | — | WO | disclosed |
| EP-0766826-A1 | SYNTHESIS OF COMBINATORIAL LIBRARIES | PHARMACOPEIA, INC. (US) | 1997-04-09 | — | — | EP | disclosed |
| US-5618825-A | ENZYME INHIBITORS; ANTICOAGULANTS; VISION DISORDERS | PHARMACOPEIA, INC. (US) | 1997-04-08 | — | — | US | disclosed |
| EP-0758313-A1 | COMBINATORIAL DIHYDROBENZOPYRAN LIBRARY | PHARMACOPEIA, INC. (US) | 1997-02-19 | — | — | EP | disclosed |
| EP-0751765-A1 | SULFONAMIDE DERIVATIVES AND THEIR USE | PHARMACOPEIA, INC. (US) | 1997-01-08 | — | — | EP | disclosed |
| WO-1995035503-A1 | SYNTHESIS OF COMBINATORIAL LIBRARIES | PHARMACOPEIA, INC. (US) | 1995-12-28 | — | — | WO | disclosed |
| WO-1995030642-A1 | COMBINATORIAL DIHYDROBENZOPYRAN LIBRARY | PHARMACOPEIA, INC. (US) | 1995-11-16 | — | — | WO | disclosed |
| WO-1995024186-A1 | SULFONAMIDE DERIVATIVES AND THEIR USE | PHARMACOPEIA, INC. (US) | 1995-09-14 | — | — | WO | disclosed |