Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | SCN1A | P35498 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6120637 | 0.86 | LMNA (0.44) | TSHRLMNACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL27590825 | 0.83 | LSS (0.42) | TSHRLMNACYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL28033051 | 0.77 | LMNA (0.58) | TSHRLMNACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL6082056 | 0.76 | TSHR (0.56) | TSHRLMNACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL14976496 | 0.75 | MEN1 (0.40) | LMNAALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL6740971 | 0.74 | CYP3A4 (0.54) | TSHRLMNACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL6740204 | 0.73 | CYP3A4 (0.52) | TSHRLMNACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL30193146 | 0.72 | LMNA (0.45) | TSHRLMNACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11807077 | 0.71 | LMNA (0.50) | LMNAALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL16682367 | 0.71 | LMNA (0.56) | TSHRLMNACYP1A2CYP3A4CYP2C19 |
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-2013078254-A1 | BICYCLIC HETEROARYL DERIVATIVES AS KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2013-05-30 | — | — | WO | disclosed |