Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 5/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18762621 | 0.92 | CYP2C9 (0.42) | CYP2C9CYP2C19CYP1A2HTTSMN1; SMN2 | |
| SCHEMBL7674937 | 0.91 | CYP2C9 (0.41) | CYP2C9CYP2C19CYP1A2HTTSMN1; SMN2 | |
| SCHEMBL5877427 | 0.88 | CYP1A2 (0.50) | CYP2C9CYP2C19CYP1A2HTTSMN1; SMN2 | |
| SCHEMBL7263399 | 0.86 | CTSK (0.41) | CYP2C9CYP2C19CYP1A2HTTSMN1; SMN2 | |
| SCHEMBL25412196 | 0.77 | CYP1A2 (0.54) | CYP2C9CYP2C19CYP1A2HTTSMN1; SMN2 | |
| SCHEMBL30615307 | 0.77 | CYP1A2 (0.54) | CYP2C9CYP2C19CYP1A2HTTSMN1; SMN2 | |
| SCHEMBL561366 | 0.75 | CYP1A2 (0.55) | CYP2C9CYP2C19CYP1A2HTTSMN1; SMN2 | |
| SCHEMBL16760 | 0.74 | CA12 (0.41) | CYP2C9CYP2C19CYP1A2HTTCA1 | |
| SCHEMBL3105952 | 0.74 | CA1 (0.40) | CYP2C9CYP2C19CYP1A2HTTCA1 | |
| SCHEMBL15663302 | 0.74 | CYP1A2 (0.54) | CYP2C9CYP2C19CYP1A2HTTSMN1; SMN2 |
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-0912511-A1 | 5-INDOLYL-2,4-PENTADIENOIC ACID DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION | Smithkline Beecham S.p.A. (IT) | 1999-05-06 | — | — | EP | disclosed |
| WO-1998001423-A1 | 5-INDOLYL-2,4-PENTADIENOIC ACID DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION | SMITHKLINE BEECHAM S.P.A. (IT) | 1998-01-15 | — | — | WO | disclosed |