Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL8110630 | 0.95 | SIGMAR1 (0.47) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 | |
| SCHEMBL1465128 | 0.84 | SIGMAR1 (0.50) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 | |
| SCHEMBL3144864 | 0.83 | SIGMAR1 (0.49) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 | |
| SCHEMBL10002496 | 0.83 | LMNA (0.53) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 | |
| SCHEMBL21034824 | 0.81 | SIGMAR1 (0.47) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 | |
| SCHEMBL30038985 | 0.81 | SIGMAR1 (0.47) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 | |
| SCHEMBL7464907 | 0.79 | L3MBTL1 (0.55) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 | |
| SCHEMBL3443849 | 0.79 | L3MBTL1 (0.51) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 | |
| SCHEMBL30683848 | 0.78 | L3MBTL1 (0.54) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 | |
| SCHEMBL7457587 | 0.78 | L3MBTL1 (0.54) | SIGMAR1L3MBTL1KMT2AHTTHDAC3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0618900-B1 | SUBSTITUTED TETRAHYDROISOQUINOLINES AND THEIR USE AS THERAPEUTIC AGENTS | KNOLL AG (DE) | 1997-03-12 | — | — | EP | disclosed |
| US-5519034-A | ANALGESICS | THE BOOTS COMPANY PLC (GB) | 1996-05-21 | — | — | US | disclosed |
| EP-0618900-A1 | SUBSTITUTED TETRAHYDROISOQUINOLINES AND THEIR USE AS THERAPEUTIC AGENTS. | BOOTS CO PLC (GB) | 1994-10-12 | — | — | EP | disclosed |