Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 4/20 | 0.52 |
| ▸ | CCND1 | P24385 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16612954 | 0.93 | LMNA (0.53) | CDK4CCND1LMNAMAPK1MTNR1A | |
| SCHEMBL16612936 | 0.84 | MTNR1A (0.50) | MTNR1AMTNR1B | |
| SCHEMBL12480072 | 0.77 | HTR2A (0.41) | CDK4CCND1LMNASMN1; SMN2 | |
| SCHEMBL16612876 | 0.77 | HTR2C (0.41) | LMNAMTNR1AMTNR1B | |
| SCHEMBL16613000 | 0.77 | HTR2A (0.42) | CDK4CCND1LMNAMTNR1AMTNR1B | |
| SCHEMBL16612854 | 0.77 | MTNR1A (0.52) | LMNAMTNR1AMTNR1BKMT2ATP53 | |
| SCHEMBL16612745 | 0.75 | HDAC6 (0.42) | LMNACYP1A2CYP3A4 | |
| SCHEMBL16612613 | 0.75 | MTNR1A (0.49) | LMNAMTNR1A | |
| SCHEMBL16612704 | 0.75 | MET (0.41) | LMNA | |
| SCHEMBL16612868 | 0.75 | MTNR1A (0.49) | LMNAMTNR1AMTNR1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-2675801-B1 | NOVEL PYRAZOLE AND IMIDAZOLE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2015-04-08 | — | — | EP | claimed |