Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | BCL9 | O00512 | 2/20 | 0.34 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL8376920 | 0.83 | HSP90AA1 (0.37) | BRD4HSP90AA1HSP90AB1ALDH1A1MAOA | |
| SCHEMBL8377054 | 0.78 | ALDH1A1 (0.40) | HSP90AA1HSP90AB1ALDH1A1KDM4ELMNA | |
| SCHEMBL3505581 | 0.68 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1ALDH1A1KDM4ELMNA | |
| SCHEMBL3504380 | 0.66 | ALDH1A1 (0.48) | HSP90AA1HSP90AB1ALDH1A1KDM4EHTT | |
| SCHEMBL6953674 | 0.65 | HSP90AA1 (0.55) | HSP90AA1HSP90AB1ALDH1A1KDM4EHTT | |
| SCHEMBL3510105 | 0.64 | ALDH1A1 (0.50) | HSP90AA1HSP90AB1ALDH1A1KDM4EHTT | |
| SCHEMBL18940345 | 0.62 | SIGMAR1 (0.41) | ALDH1A1SIGMAR1KDM4EHTTSMN1; SMN2 | |
| SCHEMBL3504376 | 0.61 | GRM4 (0.41) | HSP90AA1HSP90AB1ALDH1A1LMNA | |
| SCHEMBL8381202 | 0.61 | HSP90AA1 (0.41) | HSP90AA1HSP90AB1ALDH1A1SIGMAR1KDM4E | |
| SCHEMBL10454920 | 0.60 | HRH3 (0.72) | ALDH1A1SIGMAR1KDM4EKMT2A |
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 |