Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8329606 | 0.81 | ALDH1A1 (0.54) | ALDH1A1SIGMAR1DRD3KCNH2CYP1A2 | |
| SCHEMBL8323088 | 0.80 | DRD3 (0.46) | ALDH1A1SIGMAR1DRD3KCNH2OPRM1 | |
| SCHEMBL14149407 | 0.74 | BRD4 (0.41) | ALDH1A1CYP1A2CYP2D6CYP2C19MAPK1 | |
| SCHEMBL10754509 | 0.73 | ALDH1A1 (0.67) | ALDH1A1SIGMAR1DRD3KCNH2OPRM1 | |
| Hydrochloric Acid SCHEMBL11381615 | 0.72 | KDM4E (0.68) | ALDH1A1SIGMAR1DRD3KCNH2OPRM1 | |
| SCHEMBL11360607 | 0.70 | SIGMAR1 (0.85) | ALDH1A1SIGMAR1KCNH2LMNAKDM4E | |
| SCHEMBL23420113 | 0.70 | BRD4 (0.38) | ALDH1A1CYP1A2CYP2D6CYP2C19MAPK1 | |
| SCHEMBL30758051 | 0.69 | OPRM1 (0.45) | ALDH1A1DRD3KCNH2OPRM1OPRK1 | |
| SCHEMBL9417737 | 0.68 | SIGMAR1 (0.72) | ALDH1A1SIGMAR1KDM4EATMSMN1; SMN2 | |
| SCHEMBL23851311 | 0.68 | SIGMAR1 (0.72) | ALDH1A1SIGMAR1KDM4EATMSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0912180-A1 | HETEROCYCLIC COMPOUNDS WITH THROMBOLYTIC ACTIVITY AND THEIR USE FOR TREATING THROMBOSIS | Dupin, Jean-Pierre (FR) | 1999-05-06 | — | — | EP | claimed |
| WO-1998002162-A1 | HETEROCYCLIC COMPOUNDS WITH THROMBOLYTIC ACTIVITY AND THEIR USE FOR TREATING THROMBOSIS | DUPIN JEAN PIERRE (FR) | 1998-01-22 | — | — | WO | claimed |
| EP-0912180-A1 | HETEROCYCLIC COMPOUNDS WITH THROMBOLYTIC ACTIVITY AND THEIR USE FOR TREATING THROMBOSIS | Dupin, Jean-Pierre (FR) | 1999-05-06 | — | — | EP | disclosed |
| WO-1998002162-A1 | HETEROCYCLIC COMPOUNDS WITH THROMBOLYTIC ACTIVITY AND THEIR USE FOR TREATING THROMBOSIS | DUPIN JEAN PIERRE (FR) | 1998-01-22 | — | — | WO | disclosed |