Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
| ▸ | ALPI | P09923 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | XIAP | P98170 | 1/20 | 0.52 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.52 |
| ▸ | LAP3 | P28838 | 3/20 | 0.48 |
| ▸ | ANPEP | P15144 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2639450 | 1.00 | EPHX1 (0.56) | EPHX1TAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL623688 | 1.00 | EPHX1 (0.56) | EPHX1TAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL6486058 | 1.00 | EPHX1 (0.56) | EPHX1TAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL309963 | 1.00 | EPHX1 (0.56) | EPHX1TAAR1SLC6A2MAOASLC6A4 | |
| Hydrochloric Acid SCHEMBL5568008 | 0.98 | EPHX1 (0.54) | EPHX1TAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL8781479 | 0.98 | EPHX1 (0.54) | EPHX1TAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL6377106 | 0.90 | EPHX1 (0.47) | EPHX1TAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL6370405 | 0.90 | EPHX1 (0.47) | EPHX1TAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL24311844 | 0.90 | SRR (0.50) | EPHX1TAAR1SLC6A2MAOASLC6A4 | |
| SCHEMBL18647219 | 0.90 | SRR (0.50) | EPHX1TAAR1SLC6A2MAOASLC6A4 |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6417396-B1 | BY-PRODUCT INHIBITION; REACTING ORGANIC ALKALI OR ALKALINE EARTH METAL CARBOXYLATE, PHOSPHONATE, OR SULFONATE; ACYLATION, PHOSPHORYLATION, SULFONATION, AMIDATION, ALKYLATION, CYCLIZATION, OR CONDENSATION | Lambert, Warner | 2002-07-09 | — | — | US | disclosed |
| US-6395930-B1 | AMINE SULFIDE PHOSPHATE OR SULFATE REAGENTS | WARNER LAMBERT | 2002-05-28 | — | — | US | disclosed |
| US-6121488-A | Quenching reagents for solution phase synthesis | WARNER-LAMBERT COMPANY (US) | 2000-09-19 | — | — | US | disclosed |
| EP-0956293-A1 | THROMBIN INHIBITORS | Akzo Nobel N.V. (NL) | 1999-11-17 | — | — | EP | disclosed |
| US-5922681-A | Endothelin antagonists | WARNER-LAMBERT COMPANY (US) | 1999-07-13 | — | — | US | disclosed |
| US-5773444-A | Quinazolines as inhibitors of endothelin converting enzyme | WARNER-LAMBERT COMPANY (US) | 1998-06-30 | — | — | US | disclosed |
| WO-1998007308-A2 | THROMBIN INHIBITORS | AKZO NOBEL N.V. (NL) | 1998-02-26 | — | — | WO | disclosed |
| EP-0799221-A1 | QUINAZOLINES AS INHIBITORS OF ENDOTHELIN CONVERTING ENZYME | WARNER-LAMBERT COMPANY (US) | 1997-10-08 | — | — | EP | disclosed |
| US-5663296-A | OLIGOPEPTIDES AS HYPOTENSIVE AGENTS, CARDIOVASCULAR DISORDERS, UROGENITAL DISORDERS AND BRAIN DISORDERS | WARNER-LAMBERT COMPANY (US) | 1997-09-02 | — | — | US | disclosed |
| US-5658902-A | HYPOTENSIVE AGENTS; ANTIISCHEMIC AGENTS | WARNER-LAMBERT COMPANY (US) | 1997-08-19 | — | — | US | disclosed |
| EP-0767801-A1 | ENDOTHELIN ANTAGONISTS II | WARNER-LAMBERT COMPANY (US) | 1997-04-16 | — | — | EP | disclosed |
| US-5550110-A | PENTAPEPTIDE AND HEXAPEPTIDE ANALOGS OF ENDOTHELIN-1 | WARNER-LAMBERT COMPANY (US) | 1996-08-27 | — | — | US | disclosed |
| WO-1996019474-A1 | QUINAZOLINES AS INHIBITORS OF ENDOTHELIN CONVERTING ENZYME | WARNER-LAMBERT COMPANY (US) | 1996-06-27 | — | — | WO | disclosed |
| WO-1996000738-A1 | ENDOTHELIN ANTAGONISTS II | WARNER-LAMBERT COMPANY (US) | 1996-01-11 | — | — | WO | disclosed |
| EP-0647236-A1 | ENDOTHELIN ANTAGONISTS II | WARNER-LAMBERT COMPANY (US) | 1995-04-12 | — | — | EP | disclosed |
| WO-1994028012-A1 | HYDROXAMATE INHIBITORS OF ENDOTHELIN CONVERTING ENZYME | WARNER-LAMBERT COMPANY (US) | 1994-12-08 | — | — | WO | disclosed |
| WO-1994022906-A1 | INHIBITORS OF ENDOTHELIN CONVERTING ENZYME | WARNER-LAMBERT COMPANY (US) | 1994-10-13 | — | — | WO | disclosed |
| WO-1993021219-A1 | ENDOTHELIN ANTAGONISTS II | WARNER-LAMBERT COMPANY (US) | 1993-10-28 | — | — | WO | disclosed |