Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 4/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL4054992 | 0.89 | CCR2 (0.59) | CCR2HPGDSIGMAR1EPHX2KCNH2 | |
| SCHEMBL2977995 | 0.87 | THRB (0.48) | THRBHPGDSIGMAR1EPHX2KMT2A | |
| SCHEMBL4048483 | 0.86 | SIGMAR1 (0.48) | THRBHPGDSIGMAR1EPHX2KMT2A | |
| SCHEMBL16143720 | 0.85 | SIGMAR1 (0.44) | THRBHPGDSIGMAR1EPHX2OPRM1 | |
| SCHEMBL4049689 | 0.84 | KMT2A (0.53) | CCR2EPHX2KCNH2KMT2AMEN1 | |
| SCHEMBL206966 | 0.84 | EPHX2 (0.62) | THRBHPGDSIGMAR1EPHX2KMT2A | |
| SCHEMBL206079 | 0.84 | OPRM1 (0.54) | SIGMAR1EPHX2OPRM1OPRL1EPHX1 | |
| SCHEMBL4052851 | 0.83 | KMT2A (0.48) | KMT2AMEN1OPRM1OPRL1 | |
| SCHEMBL206084 | 0.83 | EPHX2 (0.47) | THRBHPGDSIGMAR1EPHX2OPRM1 | |
| SCHEMBL207910 | 0.83 | OPRM1 (0.50) | THRBHPGDSIGMAR1EPHX2KMT2A |
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-7476763-B2 | Oxo-substituted cyclohexyl-1,4-diamine compounds | GRUENENTHAL GMBH (DE) | 2009-01-13 | — | — | US | disclosed |