Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 8/20 | 0.36 |
| ▸ | HPGD | P15428 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 7/20 | 0.36 |
| ▸ | NPC1 | O15118 | 7/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2722735 | 0.74 | EPHX1 (0.44) | ALDH1A1EPHX1RAB9AHPGDLMNA | |
| SCHEMBL19640034 | 0.72 | EPHX1 (0.42) | ALDH1A1EPHX1RAB9AHPGDLMNA | |
| SCHEMBL1536750 | 0.72 | KMT2A (0.42) | ALDH1A1EPHX1RAB9AHPGDLMNA | |
| SCHEMBL4053495 | 0.71 | KMT2A (0.41) | ALDH1A1EPHX1RAB9AACHENPC1 | |
| SCHEMBL526390 | 0.71 | KMT2A (0.41) | ALDH1A1EPHX1RAB9AACHENPC1 | |
| SCHEMBL10780168 | 0.69 | EPHX1 (0.46) | ALDH1A1EPHX1ACHE | |
| SCHEMBL4722846 | 0.69 | ALDH1A1 (0.41) | ALDH1A1EPHX1RAB9AHPGDACHE | |
| SCHEMBL32678640 | 0.68 | EPHX1 (0.44) | ALDH1A1EPHX1RAB9AHPGDACHE | |
| SCHEMBL32678639 | 0.68 | EPHX1 (0.44) | ALDH1A1EPHX1RAB9AHPGDACHE | |
| SCHEMBL32678641 | 0.68 | EPHX1 (0.44) | ALDH1A1EPHX1RAB9AHPGDACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1189862-A1 | PREPARATION OF SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS AND CERTAIN INTERMEDIATES | BIOCRYST PHARMACEUTICALS INC. (US) | 2002-03-27 | — | — | EP | disclosed |
| WO-2001000558-A1 | PREPARATION OF SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS AND CERTAIN INTERMEDIATES | BIOCRYST PHARMACEUTICALS, INC. (US) | 2001-01-04 | — | — | WO | disclosed |