Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.53 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.51 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | METAP2 | P50579 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31069904 | 0.86 | MAOA (0.48) | PARP1TRPA1MAOAMAOBKDM4E | |
| SCHEMBL7325719 | 0.85 | MAOA (0.52) | TRPA1MAOAMAOBMAPTSMN1; SMN2 | |
| SCHEMBL4668365 | 0.84 | MAOA (0.50) | PARP1TRPA1MAOAMAOBSMN1; SMN2 | |
| SCHEMBL8961832 | 0.83 | MAOA (0.48) | PARP1TRPA1MAOAMAOBCYP2C9 | |
| SCHEMBL4777607 | 0.81 | MAOA (0.47) | PARP1TRPA1MAOAMAOBMAPT | |
| SCHEMBL7554503 | 0.81 | TRPA1 (0.50) | PARP1TRPA1MAOAMAOBMAPT | |
| SCHEMBL13098147 | 0.78 | GAA (0.54) | PARP1TRPA1MAPTTP53SMN1; SMN2 | |
| SCHEMBL6427706 | 0.78 | TRPA1 (0.58) | PARP1TRPA1MAPTKDM4EALDH1A1 | |
| SCHEMBL4777601 | 0.75 | MAOA (0.47) | MAOAMAOB | |
| SCHEMBL13777196 | 0.74 | MAOA (0.73) | MAOAMAOBMAPTSMN1; SMN2KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101243079-A | Tricyclic opioid modulators | JANSSEN PHARMACEUTICA NV (BE) | 2008-08-13 | — | — | CN | disclosed |
| EP-1896467-A2 | TRICYCLIC OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-03-12 | — | — | EP | disclosed |
| WO-2006138528-A2 | TRICYCLIC OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V (BE) | 2006-12-28 | — | — | WO | disclosed |
| US-5741715-A | FLUORESCENT POLARIZATION IMMUNOASSAY | ROCHE DIAGNOSTIC SYSTEMS, INC. (US) | 1998-04-21 | — | — | US | disclosed |