Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | UBE2M | P61081 | 1/20 | 0.33 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CCR5 | P51681 | 2/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
| ▸ | HTR1B | P28222 | 1/20 | 0.32 |
| ▸ | ICMT | O60725 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19631833 | 0.78 | SIGMAR1 (0.41) | KDM4EOPRM1SIGMAR1KMT2AALDH1A1 | |
| SCHEMBL19631875 | 0.78 | OPRM1 (0.38) | LMNANPSR1OPRM1SIGMAR1AGTR2 | |
| SCHEMBL21221683 | 0.78 | OPRM1 (0.38) | LMNANPSR1OPRM1SIGMAR1AGTR2 | |
| SCHEMBL21221670 | 0.78 | OPRM1 (0.38) | LMNANPSR1OPRM1SIGMAR1AGTR2 | |
| SCHEMBL19615078 | 0.78 | OPRM1 (0.38) | LMNANPSR1OPRM1SIGMAR1AGTR2 | |
| SCHEMBL19632009 | 0.78 | OPRM1 (0.38) | LMNANPSR1OPRM1SIGMAR1AGTR2 | |
| SCHEMBL19615076 | 0.78 | OPRM1 (0.38) | LMNANPSR1OPRM1SIGMAR1AGTR2 | |
| SCHEMBL22169548 | 0.76 | SIGMAR1 (0.40) | LMNAOPRM1SIGMAR1KMT2AALDH1A1 | |
| SCHEMBL19615050 | 0.74 | ALDH1A1 (0.46) | LMNANPSR1KDM4EOPRM1SIGMAR1 | |
| SCHEMBL19615051 | 0.74 | ALDH1A1 (0.46) | LMNANPSR1KDM4EOPRM1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017198339-A1 | TETRAHYDROPYRAN AND THIOPYRAN DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2017-11-23 | — | — | WO | disclosed |