Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | CACNA1G | O43497 | 10/20 | 0.41 |
| ▸ | CACNA1H | O95180 | 10/20 | 0.41 |
| ▸ | CACNA1I | Q9P0X4 | 10/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
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 SCHEMBL6976215 | 0.99 | ALDH1A1 (0.41) | ALDH1A1HTTSIGMAR1TMEM97CACNA1G | |
| SCHEMBL6975032 | 0.87 | OPRD1 (0.42) | ALDH1A1SIGMAR1OPRL1 | |
| Hydrochloric Acid SCHEMBL6980309 | 0.86 | OPRD1 (0.41) | ALDH1A1SIGMAR1OPRL1 | |
| SCHEMBL6976116 | 0.86 | CCR3 (0.46) | ALDH1A1SIGMAR1CACNA1GCACNA1HCACNA1I | |
| SCHEMBL6976284 | 0.86 | OPRL1 (0.48) | ALDH1A1SIGMAR1OPRL1 | |
| Hydrochloric Acid SCHEMBL6971416 | 0.85 | CCR3 (0.45) | ALDH1A1SIGMAR1CACNA1GCACNA1HCACNA1I | |
| SCHEMBL6973419 | 0.84 | OPRL1 (0.53) | HTTSIGMAR1OPRL1 | |
| SCHEMBL6969059 | 0.84 | SIGMAR1 (0.51) | ALDH1A1HTTSIGMAR1CACNA1GCACNA1H | |
| SCHEMBL6968917 | 0.84 | JAK2 (0.41) | ALDH1A1HTTDRD4OPRL1 | |
| Hydrochloric Acid SCHEMBL6976568 | 0.83 | OPRL1 (0.52) | SIGMAR1OPRL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6566376-B1 | For therapy of chemokine receptor related diseases and conditions such as rheumatoid arthritis, chronic obstructive pulmonary disease | ASTRAZENECA UK LIMITED (GB) | 2003-05-20 | — | — | US | claimed |
| EP-1202984-B1 | DIPHENYL-PIPERIDINE DERIVATE | ASTRAZENECA UK LTD (GB) | 2003-03-05 | — | — | EP | claimed |
| US-6566376-B1 | For therapy of chemokine receptor related diseases and conditions such as rheumatoid arthritis, chronic obstructive pulmonary disease | ASTRAZENECA UK LIMITED (GB) | 2003-05-20 | — | — | US | disclosed |
| EP-1202984-B1 | DIPHENYL-PIPERIDINE DERIVATE | ASTRAZENECA UK LTD (GB) | 2003-03-05 | — | — | EP | disclosed |