Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | ACACB | O00763 | 3/20 | 0.59 |
| ▸ | ACACA | Q13085 | 3/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | PRCP | P42785 | 1/20 | 0.56 |
| ▸ | PDE2A | O00408 | 1/20 | 0.55 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.54 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.54 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.54 |
| ▸ | CDK1 | P06493 | 1/20 | 0.54 |
| ▸ | CSF1R | P07333 | 1/20 | 0.54 |
| ▸ | PRKACA | P17612 | 1/20 | 0.54 |
| ▸ | FLT1 | P17948 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL247742 | 0.88 | HSD17B10 (0.63) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL249524 | 0.88 | HSD17B10 (0.63) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL2672977 | 0.88 | HSD17B10 (0.63) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL7736414 | 0.87 | ACACB (0.77) | ALDH1A1MAPTHPGDACACBACACA | |
| Hydrochloric Acid SCHEMBL4459970 | 0.86 | HSD17B10 (0.61) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL9718520 | 0.86 | HSD17B10 (0.61) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| Chloromethane SCHEMBL29855624 | 0.84 | HSD17B10 (0.59) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL21877013 | 0.84 | ROCK2 (0.66) | ALDH1A1MAPTHPGDACACBACACA | |
| SCHEMBL21877014 | 0.84 | ROCK2 (0.66) | ALDH1A1MAPTHPGDACACBACACA | |
| SCHEMBL28210163 | 0.82 | HSD17B10 (0.58) | ALDH1A1MAPTHPGDMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2274287-B1 | INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 | VITAE PHARMACEUTICALS INC (US) | 2016-03-09 | — | — | EP | disclosed |