Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | USP2 | O75604 | 4/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL289351 | 0.84 | OPRM1 (0.42) | MEN1KMT2ACYP2C9USP2CYP11B1 | |
| SCHEMBL29889297 | 0.83 | CYP11B1 (0.41) | MEN1KMT2ACYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL16600198 | 0.83 | CYP11B1 (0.41) | MEN1KMT2ACYP11B1CYP11B2OPRM1 | |
| SCHEMBL14804554 | 0.82 | OPRM1 (0.41) | MEN1KMT2ACYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL18690046 | 0.79 | CYP11B1 (0.39) | MEN1KMT2ACYP2C9TSHRUSP2 | |
| SCHEMBL289578 | 0.79 | DDB1 (0.43) | USP2CYP11B1CYP11B2SMN1; SMN2 | |
| SCHEMBL8008730 | 0.78 | CYP11B1 (0.48) | TSHRCYP11B1CYP11B2OPRM1OPRL1 | |
| SCHEMBL31580332 | 0.78 | CYP11B1 (0.40) | CYP2C9TSHRCYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL29626701 | 0.77 | CYP11B1 (0.39) | CYP2C9CYP11B1CYP11B2ALDH1A1CYP2C19 | |
| SCHEMBL15417793 | 0.76 | HTT (0.40) | KMT2ACYP11B1CYP11B2MAPK1 |
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-8623857-B2 | N-phenyl imidazole carboxamide inhibitors of 3-phosphoinositide-dependent protein kinase-1 | MERCK SHARP & DOHME CORP. (US) | 2014-01-07 | — | — | US | disclosed |