Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9767970 | 0.89 | KCNN4 (0.38) | ALDH1A1TSHROPRM1CYP3A4CYP2D6 | |
| SCHEMBL9767862 | 0.75 | KCNN4 (0.35) | ALDH1A1TSHRKIF11OPRM1RAB9A | |
| SCHEMBL9768017 | 0.75 | MMP1 (0.33) | ALDH1A1 | |
| SCHEMBL17935605 | 0.72 | ALDH1A1 (0.61) | ALDH1A1TSHRKIF11TRPV6CYP19A1 | |
| SCHEMBL9767832 | 0.71 | KIF11 (0.45) | ALDH1A1KIF11KDM1APPARGPPARA | |
| SCHEMBL17935607 | 0.71 | ALDH1A1 (0.58) | ALDH1A1TSHRKIF11TRPV6CYP19A1 | |
| Trifluoromethylbenzene SCHEMBL14121438 | 0.71 | TSHR (0.93) | ALDH1A1TSHRKIF11TRPV6CYP19A1 | |
| Trifluoromethylbenzene SCHEMBL1830622 | 0.71 | TSHR (0.93) | ALDH1A1TSHRKIF11TRPV6CYP19A1 | |
| SCHEMBL1148767 | 0.70 | KCNN4 (0.40) | ALDH1A1TSHRKIF11OPRM1NPC1 | |
| Trifluoromethylbenzene SCHEMBL3392949 | 0.69 | TSHR (0.70) | ALDH1A1TSHRKIF11TRPV6SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5022914-A | Pre- and post-emergence; broad leaf plants; rice | BASF AKTIENGESELLSCHAFT (DE) | 1991-06-11 | — | — | US | disclosed |