Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 6/20 | 0.55 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | METAP2 | P50579 | 5/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4367847 | 1.00 | METAP1 (0.55) | METAP1LPAR2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL4377210 | 1.00 | METAP1 (0.55) | METAP1LPAR2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL4366029 | 0.85 | METAP1 (0.53) | METAP1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL4380056 | 0.81 | LPAR2 (0.57) | LPAR2SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL4380066 | 0.81 | LPAR2 (0.57) | LPAR2SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL13624132 | 0.81 | METAP1 (0.64) | METAP1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL11208586 | 0.81 | METAP1 (0.63) | METAP1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL4367952 | 0.78 | EPHX2 (0.52) | METAP1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL4366086 | 0.78 | METAP1 (0.51) | METAP1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL4367996 | 0.78 | METAP1 (0.60) | METAP1SMN1; SMN2NPC1RAB9AKDM4E |
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-7622592-B2 | Carbonylamino-benzimidazole derivatives as androgen receptor modulators | MERCK & CO., INC. (US) | 2009-11-24 | — | — | US | disclosed |