Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | HPGD | P15428 | 4/20 | 0.67 |
| ▸ | RAB9A | P51151 | 4/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.67 |
| ▸ | NPC1 | O15118 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 2/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.67 |
| ▸ | MAPT | P10636 | 2/20 | 0.67 |
| ▸ | GLA | P06280 | 1/20 | 0.67 |
| ▸ | GAA | P10253 | 1/20 | 0.67 |
| ▸ | ATM | Q13315 | 1/20 | 0.67 |
| ▸ | CDK1 | P06493 | 1/20 | 0.58 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10464237 | 0.89 | CDK1 (0.64) | ALDH1A1HPGDRAB9AKDM4EKMT2A | |
| SCHEMBL9779509 | 0.85 | CDK1 (0.67) | ALDH1A1HPGDRAB9AKDM4EKMT2A | |
| SCHEMBL9779201 | 0.83 | KDM4E (0.69) | ALDH1A1HPGDRAB9AKDM4EKMT2A | |
| SCHEMBL5567460 | 0.80 | KDM4E (1.00) | ALDH1A1HPGDRAB9AKDM4EKMT2A | |
| SCHEMBL31501839 | 0.80 | KDM4E (0.61) | ALDH1A1HPGDRAB9AKDM4EKMT2A | |
| SCHEMBL4040141 | 0.80 | KDM4E (0.61) | ALDH1A1HPGDRAB9AKDM4EKMT2A | |
| SCHEMBL10506586 | 0.79 | ALDH1A1 (0.59) | ALDH1A1HPGDRAB9AKDM4EKMT2A | |
| SCHEMBL4045458 | 0.79 | RAB9A (0.59) | ALDH1A1HPGDRAB9AKDM4EKMT2A | |
| SCHEMBL15367087 | 0.79 | KDM4E (0.63) | ALDH1A1HPGDRAB9AKDM4EKMT2A | |
| SCHEMBL4168669 | 0.78 | RAB9A (0.59) | ALDH1A1HPGDRAB9AKDM4EKMT2A |
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-4999369-A | Antitumor agents | BURROUGHS WELLCOME CO. (US) | 1991-03-12 | — | — | US | disclosed |
| US-4910218-A | With a hydroxy containing secondary amine group | BURROUGHS WELLCOME CO. (US) | 1990-03-20 | — | — | US | disclosed |