Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 8/20 | 0.49 |
| ▸ | BCHE | P06276 | 7/20 | 0.49 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.43 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.43 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.43 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8542085 | 0.83 | ACHE (0.50) | ACHEBCHEDRD4KDM4EALDH1A1 | |
| SCHEMBL8550674 | 0.79 | DRD4 (0.40) | ACHEBCHEDRD4KDM4ECA2 | |
| SCHEMBL4520161 | 0.73 | CCNT1 (0.46) | DRD4KDM4EALDH1A1HSD17B10CYP1A2 | |
| SCHEMBL8543201 | 0.71 | ACHE (0.51) | ACHEBCHEDRD4KDM4EALDH1A1 | |
| SCHEMBL9875563 | 0.70 | KDM4E (0.68) | ACHEBCHEKDM4EALDH1A1HSD17B10 | |
| SCHEMBL8542931 | 0.70 | ACHE (0.50) | ACHEBCHEKDM4EALDH1A1HSD17B10 | |
| SCHEMBL8544712 | 0.69 | ACHE (0.49) | ACHEBCHEDRD4KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL8542681 | 0.69 | ACHE (0.49) | ACHEBCHEDRD4KDM4EALDH1A1 | |
| SCHEMBL9587655 | 0.68 | ACHE (0.51) | ACHEBCHEKDM4EALDH1A1HSD17B10 | |
| SCHEMBL8544321 | 0.67 | BCHE (0.46) | ACHEBCHEKDM4EALDH1A1HSD17B10 |
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-5179100-A | Analgesics | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1993-01-12 | — | — | US | claimed |
| EP-0560231-B1 | Pyrazolo(3,4-a)acridine derivatives as analgesics | HOECHST MARION ROUSSEL INC (US) | 1998-06-03 | — | — | EP | disclosed |
| EP-0560231-A1 | Pyrazolo(3,4-a)acridine derivatives as analgesics | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1993-09-15 | — | — | EP | disclosed |
| US-5179100-A | Analgesics | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1993-01-12 | — | — | US | disclosed |