Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.52 |
| ▸ | HPGD | P15428 | 6/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 6/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.51 |
| ▸ | CA9 | Q16790 | 5/20 | 0.51 |
| ▸ | GAA | P10253 | 4/20 | 0.51 |
| ▸ | GLA | P06280 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.51 |
| ▸ | CASP1 | P29466 | 2/20 | 0.51 |
| ▸ | CASP7 | P55210 | 2/20 | 0.51 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.51 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6081510 | 0.89 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDSMN1; SMN2NPC1 | |
| SCHEMBL9081412 | 0.85 | ALDH1A1 (0.55) | DRD4ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL27886642 | 0.83 | CA9 (0.61) | DRD4ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL11229124 | 0.82 | DRD4 (0.55) | DRD4ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL11229120 | 0.81 | CA12 (0.53) | DRD4ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL8834873 | 0.80 | CA12 (0.58) | DRD4ALDH1A1KDM4ECA12CA9 | |
| SCHEMBL7917887 | 0.80 | CA12 (0.52) | DRD4ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL10024912 | 0.80 | KDM4E (0.64) | DRD4ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL11118650 | 0.79 | DRD4 (0.58) | DRD4ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL7917214 | 0.78 | ALDH1A1 (0.51) | DRD4ALDH1A1KDM4EHPGDSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5550129-A | THERAPY FOR NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS | WILLMAR SCHWABE GMBH & CO. (DE) | 1996-08-27 | — | — | US | disclosed |