Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BCL9 | O00512 | 2/20 | 0.35 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8376026 | 0.83 | BRD4 (0.36) | HSP90AA1HSP90AB1SIGMAR1BRD4BCL9 | |
| SCHEMBL8381202 | 0.75 | HSP90AA1 (0.41) | HSP90AA1HSP90AB1SIGMAR1ALDH1A1CYP2C9 | |
| SCHEMBL1565830 | 0.63 | SIGMAR1 (0.41) | SIGMAR1ALDH1A1HRH3ATMMEN1 | |
| SCHEMBL8377054 | 0.63 | ALDH1A1 (0.40) | HSP90AA1HSP90AB1ALDH1A1CYP2C9ALOX15 | |
| SCHEMBL11755551 | 0.62 | SIGMAR1 (0.46) | SIGMAR1ALDH1A1CYP2C9ALOX15HSD17B10 | |
| SCHEMBL16815115 | 0.62 | CYP2C9 (0.57) | ALDH1A1CYP2C9ALOX15HSD17B10ATM | |
| SCHEMBL12005459 | 0.62 | SIGMAR1 (0.46) | SIGMAR1CYP2C9ALOX15HSD17B10ATM | |
| SCHEMBL3505581 | 0.62 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1ALDH1A1ALOX15HSD17B10 | |
| SCHEMBL3718831 | 0.62 | SIGMAR1 (0.60) | SIGMAR1HRH3ATMMEN1POLB | |
| SCHEMBL10454920 | 0.62 | HRH3 (0.72) | SIGMAR1ALDH1A1CYP2C9ALOX15HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5925766-A | COGNITION ACTIVATORS FOR DECREASING CHOLINERGIC FUNCTION OF ALZHEIMER*S DISEASE AND ARE ENZYME INHIBITORS OF MONOAMINE OXIDASE AND ARE ANTIDEPRESSANTS | HOECHST MARION ROUSSEL, INC. (US) | 1999-07-20 | — | — | US | disclosed |
| US-5756754-A | Substituted 3-(aminoalkylamino)-1,2-benzisoxazoles and related compounds | HOECHST MARION ROUSSEL, INC. (US) | 1998-05-26 | — | — | US | disclosed |