Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | JUN | P05412 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7987418 | 0.75 | CYP1A2 (0.58) | NAPRTALDH1A1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL28320267 | 0.72 | CYP19A1 (0.43) | CYP19A1NAPRTUSP2RAB9AALDH1A1 | |
| SCHEMBL29091784 | 0.71 | KIF11 (0.54) | CYP19A1NAPRTUSP2RAB9ACYP1A2 | |
| SCHEMBL5720583 | 0.71 | TSHR (0.50) | CYP19A1USP2RAB9AALDH1A1MEN1 | |
| SCHEMBL7265049 | 0.69 | CYP19A1 (0.44) | CYP19A1USP2RAB9AALDH1A1MEN1 | |
| SCHEMBL20412356 | 0.68 | NAPRT (0.48) | CYP19A1NAPRTUSP2RAB9AALDH1A1 | |
| SCHEMBL27610091 | 0.68 | CYP19A1 (0.50) | CYP19A1NAPRTUSP2RAB9AALDH1A1 | |
| SCHEMBL16886277 | 0.68 | CYP19A1 (0.51) | CYP19A1NAPRTUSP2RAB9AKMT2A | |
| SCHEMBL12909254 | 0.67 | KIF11 (0.48) | CYP19A1USP2RAB9AALDH1A1MEN1 | |
| SCHEMBL14486637 | 0.67 | KIF11 (0.46) | CYP19A1USP2RAB9AALDH1A1MEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6255326-B1 | ANTIINFLAMMATORY AGENT; AUTOIMMUNE DISEASES | AVENTIS PHARMA LIMITED (GB) | 2001-07-03 | — | — | US | disclosed |