Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.50 |
| ▸ | EDNRA | P25101 | 5/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.46 |
| ▸ | WNT3A | P56704 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | OGA | O60502 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7976622 | 0.93 | MAPK9 (0.47) | MAPK1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7990464 | 0.92 | MAPK9 (0.54) | MAPK1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7989760 | 0.88 | ALDH1A1 (0.59) | MAPK1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7976186 | 0.83 | MAPK9 (0.43) | MAPK1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7987077 | 0.83 | NPC1 (0.55) | MAPK1CYP1A2CYP2C9CYP2C19MAPK9 | |
| SCHEMBL7976061 | 0.83 | NPC1 (0.46) | MAPK1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7986595 | 0.82 | PTGS1 (0.55) | MAPK9PTGS1PTGS2ALDH1A1HPGD | |
| SCHEMBL7990089 | 0.82 | EDNRA (0.60) | CYP3A4EDNRARAB9AALDH1A1KDM4E | |
| SCHEMBL7993145 | 0.80 | LMNA (0.50) | MAPK1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8035766 | 0.80 | PTGS1 (0.59) | MAPK1CYP1A2CYP3A4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-6207686-B1 | FOR THERAPY OF HYPERTENSION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-03-27 | — | — | US | disclosed |
| WO-1996015109-A1 | ENDOTHELIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-05-23 | — | — | WO | disclosed |