Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 8/20 | 0.40 |
| ▸ | DRD4 | P21917 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.39 |
| ▸ | CHRNG | P07510 | 1/20 | 0.39 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 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 | |
|---|---|---|---|---|
| SCHEMBL11364231 | 0.83 | OPRM1 (0.41) | ALDH1A1CYP1A2CYP3A4OPRM1OPRD1 | |
| SCHEMBL12844042 | 0.82 | OPRL1 (0.49) | ALDH1A1OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL25740959 | 0.82 | OPRL1 (0.49) | ALDH1A1OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL19262091 | 0.82 | SLC6A3 (0.43) | OPRM1OPRD1OPRK1OPRL1DRD2 | |
| SCHEMBL18019019 | 0.80 | CHRNA1 (0.45) | LMNAALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL9542156 | 0.80 | CHRNA1 (0.45) | LMNAALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL10606317 | 0.79 | OPRM1 (0.43) | LMNAALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL10606314 | 0.79 | OPRM1 (0.43) | LMNAALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11796702 | 0.78 | OPRM1 (0.45) | LMNAALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL16591193 | 0.78 | OPRM1 (0.45) | LMNAALDH1A1CYP1A2CYP3A4CYP2C19 |
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-9738642-B2 | Triazolopyridine ether derivatives and their use in neurological and pyschiatric disorders | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-08-22 | — | — | US | disclosed |