Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.57 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.37 |
| ▸ | TYMP | P19971 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| SCHEMBL5898006 | 0.85 | CYP1A2 (0.55) | CYP1A2CYP2A6ALDH1A1APOBEC3AAPOBEC3G | |
| SCHEMBL7653944 | 0.83 | CYP1A2 (0.59) | CYP1A2CYP2A6ALDH1A1APOBEC3AAPOBEC3G | |
| SCHEMBL8852070 | 0.81 | CYP1A2 (0.57) | CYP1A2CYP2A6ALDH1A1APOBEC3AAPOBEC3G | |
| SCHEMBL13476109 | 0.81 | CYP2A6 (0.57) | CYP1A2CYP2A6ALDH1A1APOBEC3AAPOBEC3G | |
| SCHEMBL7260880 | 0.81 | CYP1A2 (0.57) | CYP1A2CYP2A6ALDH1A1APOBEC3AAPOBEC3G | |
| SCHEMBL6367430 | 0.79 | CYP1A2 (0.57) | CYP1A2CYP2A6ALDH1A1APOBEC3AAPOBEC3G | |
| SCHEMBL25877344 | 0.78 | CYP1A2 (0.52) | CYP1A2CYP2A6ALDH1A1APOBEC3AAPOBEC3G | |
| SCHEMBL24264851 | 0.77 | CYP1A2 (0.60) | CYP1A2CYP2A6HPGDKDM4EHSD17B10 | |
| SCHEMBL8851565 | 0.77 | CYP1A2 (0.55) | CYP1A2CYP2A6ALDH1A1APOBEC3AAPOBEC3G | |
| SCHEMBL23465385 | 0.77 | CYP1A2 (0.55) | CYP1A2CYP2A6ALDH1A1APOBEC3AAPOBEC3G |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003055856-A2 | BICYCLIC LACTAM DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF-α CONVERTING ENZYME (TACE) | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-07-10 | — | — | WO | disclosed |