Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL9041102 | 0.88 | CYP1A2 (0.58) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 | |
| SCHEMBL9042096 | 0.82 | CYP1A2 (0.60) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 | |
| SCHEMBL9039716 | 0.81 | ACHE (0.51) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 | |
| SCHEMBL10446963 | 0.79 | CYP1A2 (0.53) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 | |
| SCHEMBL9378893 | 0.77 | CYP1A2 (0.60) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 | |
| SCHEMBL4501798 | 0.77 | CYP1A2 (0.62) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 | |
| SCHEMBL9738138 | 0.76 | CYP1A2 (0.58) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 | |
| SCHEMBL9378050 | 0.76 | CYP1A2 (0.52) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 | |
| SCHEMBL9381492 | 0.75 | CYP1A2 (0.57) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 | |
| SCHEMBL3807927 | 0.75 | CYP1A2 (0.72) | CYP1A2CYP2C9TSHRALDH1A1NR3C1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6075144-A | ABILITY TO INHIBIT ACETYLCHOLINESTERASE; TREATS ALZHEIMER,S DISEASE | HOECHST MARION ROUSSEL, INC. (US) | 2000-06-13 | — | — | US | claimed |
| US-6248750-B1 | CHOLINERGIC FUNCTION AGONISTS FOR MEMORY ENHANCEMENT | HOECHST ROUSSEL PHARMACEUTICALS | 2001-06-19 | — | — | US | disclosed |
| US-6075144-A | ABILITY TO INHIBIT ACETYLCHOLINESTERASE; TREATS ALZHEIMER,S DISEASE | HOECHST MARION ROUSSEL, INC. (US) | 2000-06-13 | — | — | US | disclosed |