Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.76 |
| ▸ | MAPT | P10636 | 4/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.76 |
| ▸ | RAB9A | P51151 | 2/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.73 |
| ▸ | NPC1 | O15118 | 1/20 | 0.73 |
| ▸ | GAA | P10253 | 1/20 | 0.73 |
| ▸ | HPGD | P15428 | 1/20 | 0.73 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.73 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL3809960 | 0.86 | ALDH1A1 (1.00) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL653579 | 0.85 | ALDH1A1 (1.00) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL245082 | 0.84 | ALDH1A1 (0.72) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL10925574 | 0.84 | MAPT (0.85) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL246421 | 0.80 | ALDH1A1 (0.74) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL2739313 | 0.79 | ALDH1A1 (0.62) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL6766300 | 0.79 | MAOA (0.56) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL11087760 | 0.78 | MAPT (0.67) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL10558163 | 0.78 | ALDH1A1 (0.68) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL11090808 | 0.77 | MAPT (0.66) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E |
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-4616023-A | CARDIOVASCULAR DISORDERS; CALCIUM BLOCKING AGENTS | MERCK & CO., INC. (US) | 1986-10-07 | — | — | US | disclosed |