Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | SCN1A | P35498 | 3/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4002970 | 0.89 | TSHR (0.53) | TSHRALDH1A1HTTCYP2C19CYP1A2 | |
| SCHEMBL1076574 | 0.85 | TSHR (0.50) | TSHRALDH1A1HTTCYP2C19CYP1A2 | |
| SCHEMBL1131428 | 0.84 | ALDH1A1 (0.49) | TSHRALDH1A1HTTCYP2C19CYP1A2 | |
| SCHEMBL6761557 | 0.84 | TSHR (0.49) | TSHRALDH1A1HTTCYP2C19CYP1A2 | |
| SCHEMBL3388066 | 0.82 | CYP2C19 (0.52) | TSHRALDH1A1HTTCYP2C19CYP1A2 | |
| SCHEMBL27283802 | 0.82 | TSHR (0.47) | TSHRALDH1A1HTTCYP2C19CYP1A2 | |
| SCHEMBL27495103 | 0.82 | CYP2C19 (0.52) | TSHRALDH1A1HTTCYP2C19CYP1A2 | |
| SCHEMBL8904062 | 0.82 | ALDH1A1 (0.47) | TSHRALDH1A1CYP2C19KIF11HIF1A | |
| SCHEMBL28002877 | 0.81 | ALDH1A1 (0.46) | TSHRALDH1A1CYP2C19HIF1AGAA | |
| SCHEMBL8904460 | 0.81 | ALDH1A1 (0.46) | TSHRALDH1A1CYP2C19HIF1AGAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-101711106-B | Pharmaceutical use of substituted amides | HIGH POINT PHARMACEUTICALS LLC | 2013-02-06 | — | — | CN | disclosed |
| CN-101711106-A | Pharmaceutical use of substituted amides | TRANSTECH PHARMA INC | 2010-05-19 | — | — | CN | disclosed |
| CN-101652359-A | Indole- and benzimidazole amides as hydroxysteroid dehydrogenase inhibitors | TRANSTECH PHARMA INC US | 2010-02-17 | — | — | CN | disclosed |