Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | CSF1R | P07333 | 1/20 | 0.44 |
| ▸ | RET | P07949 | 1/20 | 0.44 |
| ▸ | MET | P08581 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 1/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.44 |
| ▸ | CDK8 | P49336 | 1/20 | 0.44 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.44 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL3516698 | 0.85 | BRS3 (0.46) | NPC1RXFP1CYP11B1CYP11B2AURKA | |
| SCHEMBL3823523 | 0.83 | GRM5 (0.41) | NPC1RXFP1CYP11B1CYP11B2AURKA | |
| SCHEMBL3824034 | 0.80 | NPC1 (0.38) | NPC1RXFP1CYP11B1CYP11B2BRS3 | |
| SCHEMBL508027 | 0.79 | FYN (0.56) | NPC1RXFP1CYP11B1CYP11B2AURKA | |
| SCHEMBL507838 | 0.79 | CYP11B1 (0.47) | NPC1RXFP1CYP11B1CYP11B2AURKA | |
| SCHEMBL32670328 | 0.79 | CYP11B1 (0.47) | NPC1RXFP1CYP11B1CYP11B2AURKA | |
| SCHEMBL6851863 | 0.79 | HDAC4 (0.40) | NPC1SMN1; SMN2RAB9ATP53CYP3A4 | |
| SCHEMBL3823318 | 0.79 | RAB9A (0.53) | NPC1RXFP1CYP11B1CYP11B2AURKA | |
| SCHEMBL17610081 | 0.79 | CYP11B1 (0.47) | NPC1RXFP1CYP11B1CYP11B2AURKA | |
| SCHEMBL30083483 | 0.79 | LOXL2 (0.54) | NPC1RXFP1CYP11B1CYP11B2AURKA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2091937-A2 | SUBSTITUTED IMIDAZOLES AS BOMBESIN RECEPTOR SUBTYPE-3 MODULATORS | Merck & Co., Inc. (US) | 2009-08-26 | — | — | EP | disclosed |
| WO-2008051406-A2 | SUBSTITUTED IMIDAZOLES AS BOMBESIN RECEPTOR SUBTYPE-3 MODULATORS | MERCK & CO., INC. (US) | 2008-05-02 | — | — | WO | disclosed |