Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.31 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8765870 | 0.71 | SLC13A5 (0.32) | HTT | |
| SCHEMBL8765579 | 0.71 | ESR1 (0.42) | MAPTHDAC3HPGDCYP2C19ALDH1A1 | |
| SCHEMBL8766524 | 0.69 | CTDSP1 (0.33) | CYP2C9 | |
| SCHEMBL9402238 | 0.67 | MAPT (0.44) | MAPTL3MBTL1RECQLCYP2C19ALDH1A1 | |
| SCHEMBL28529969 | 0.67 | KMT2A (0.46) | MAPTL3MBTL1RECQLCYP2C19ALDH1A1 | |
| SCHEMBL27964089 | 0.67 | MAPT (0.44) | MAPTL3MBTL1RECQLCYP2C19ALDH1A1 | |
| SCHEMBL5041397 | 0.65 | MAPT (0.43) | MAPTL3MBTL1HPGDGLARECQL | |
| Hydrochloric Acid SCHEMBL9402285 | 0.65 | MAPT (0.43) | MAPTL3MBTL1RECQLCYP2C19ALDH1A1 | |
| SCHEMBL1613425 | 0.65 | MAPT (0.47) | MAPTCYP2C19ALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL8478567 | 0.64 | PTPN1 (0.42) | MAPTL3MBTL1RECQLCYP2C19ALDH1A1 |
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-0785782-A1 | DISUBSTITUTED ACETYLENES BEARING HETEROAROMATIC AND HETEROBICYCLIC GROUPS HAVING RETINOID-LIKE ACTIVITY | Allergan (US) | 1997-07-30 | — | — | EP | disclosed |
| WO-1996011686-A1 | DISUBSTITUTED ACETYLENES BEARING HETEROAROMATIC AND HETEROBICYCLIC GROUPS HAVING RETINOID-LIKE ACTIVITY | ALLERGAN (US) | 1996-04-25 | — | — | WO | disclosed |