Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 3/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.31 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | RAD52 | P43351 | 1/20 | 0.30 |
| ▸ | APAF1 | O14727 | 1/20 | 0.30 |
| ▸ | TDP2 | O95551 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8724618 | 0.81 | ALDH1A1 (0.34) | OPRD1KCNH2ALDH1A1MAPTGLA | |
| SCHEMBL11185934 | 0.79 | MAPT (0.36) | OPRD1KCNH2ALDH1A1MAPTGLA | |
| SCHEMBL29191735 | 0.79 | ALDH1A1 (0.39) | OPRD1KCNH2ALDH1A1MAPTGLA | |
| SCHEMBL7732353 | 0.75 | ATM (0.33) | — | |
| SCHEMBL8482855 | 0.75 | CTDSP1 (0.35) | OPRD1KCNH2ALDH1A1MAPTGLA | |
| SCHEMBL9246235 | 0.71 | ABCC9 (0.31) | — | |
| SCHEMBL9354700 | 0.70 | MAPT (0.33) | OPRD1KCNH2ALDH1A1MAPTGLA | |
| SCHEMBL7735466 | 0.70 | TDP1 (0.40) | ALDH1A1MAPTGLA | |
| SCHEMBL13009960 | 0.70 | IDO1 (0.34) | OPRD1KCNH2ALDH1A1MAPTGLA | |
| SCHEMBL68917 | 0.68 | ALDH1A1 (0.50) | ALDH1A1MAPTIDO1HPGD |
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-1991009031-A1 | TRIFLUOROMETHYL SUBSTITUTED COMPOUNDS AND A PHARMACEUTICAL COMPOSITION | BEECHAM GROUP PLC (GB) | 1991-06-27 | — | — | WO | disclosed |