Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.63 |
| ▸ | RARA | P10276 | 1/20 | 0.63 |
| ▸ | RARB | P10826 | 1/20 | 0.63 |
| ▸ | RARG | P13631 | 1/20 | 0.63 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PABPC1 | P11940 | 2/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.35 |
| ▸ | EIF4H | Q15056 | 2/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.35 |
| ▸ | PRKCA | P17252 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PRKCG | P05129 | 1/20 | 0.34 |
| ▸ | PRKCB | P05771 | 1/20 | 0.34 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.34 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL727818 | 0.88 | CYP3A4 (0.46) | CYP3A4KMT2ARARARARBRARG | |
| SCHEMBL8330805 | 0.86 | CYP3A4 (0.58) | CYP3A4KMT2ARARARARBRARG | |
| SCHEMBL8630933 | 0.82 | RARA (0.75) | CYP3A4KMT2ARARARARBRARG | |
| SCHEMBL9334980 | 0.80 | RARA (0.67) | CYP3A4KMT2ARARARARBRARG | |
| SCHEMBL6591091 | 0.80 | KMT2A (0.38) | CYP3A4KMT2ARARARARBRARG | |
| SCHEMBL995850 | 0.80 | RARB (0.74) | CYP3A4KMT2ARARARARBRARG | |
| SCHEMBL6591370 | 0.79 | KMT2A (0.41) | CYP3A4KMT2ARARARARBRARG | |
| SCHEMBL6593885 | 0.79 | RARA (0.57) | CYP3A4KMT2ARARARARBRARG | |
| SCHEMBL7635706 | 0.79 | RARB (0.67) | CYP3A4KMT2ARARARARBRARG | |
| SCHEMBL6591838 | 0.78 | RARA (0.56) | CYP3A4KMT2ARARARARBRARG |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1042313-B1 | BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES HAVING RETINOID ANTAGONIST LIKE ACTIVITY | ALLERGAN INC (US) | 2004-04-28 | — | — | EP | disclosed |
| EP-1042313-A1 | BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES HAVING RETINOID ANTAGONIST LIKE ACTIVITY | Allergan Sales, Inc. (US) | 2000-10-11 | — | — | EP | disclosed |
| WO-1999033821-A1 | BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES HAVING RETINOID ANTAGONIST-LIKE ACTIVITY | ALLERGAN SALES, INC. (US) | 1999-07-08 | — | — | WO | disclosed |