Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 5/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9815300 | 0.98 | OPRD1 (0.57) | OPRD1RAB9ASIGMAR1OPRK1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9815301 | 0.98 | OPRD1 (0.57) | OPRD1RAB9ASIGMAR1OPRK1ALDH1A1 | |
| SCHEMBL9815285 | 0.84 | RAB9A (0.57) | OPRD1RAB9ASIGMAR1OPRK1ALDH1A1 | |
| SCHEMBL9815271 | 0.84 | OPRD1 (0.70) | OPRD1OPRK1ALDH1A1KDM4E | |
| SCHEMBL10434728 | 0.83 | OPRD1 (0.63) | OPRD1OPRK1ALDH1A1MAPK1 | |
| Hydrochloric Acid SCHEMBL9815366 | 0.82 | OPRD1 (0.68) | OPRD1SIGMAR1OPRK1ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL9815288 | 0.82 | RAB9A (0.55) | OPRD1RAB9ASIGMAR1OPRK1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9815363 | 0.82 | OPRD1 (0.68) | OPRD1SIGMAR1OPRK1ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL9815311 | 0.82 | RAB9A (0.55) | OPRD1RAB9ASIGMAR1OPRK1ALDH1A1 | |
| SCHEMBL10434790 | 0.81 | OPRD1 (0.61) | OPRD1OPRK1MAPK1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0232989-B1 | ISOQUINOLINE DERIVATIVES | Dr. Lo. Zambeletti S.p.A. (IT) | 1991-08-21 | — | — | EP | disclosed |
| EP-0374756-A2 | Nitrogen-containing cyclic compounds | MERCK PATENT GmbH (DE) | 1990-06-27 | — | — | EP | disclosed |