Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CETP | P11597 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8553179 | 0.85 | ALDH1A1 (0.53) | ALDH1A1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL29106576 | 0.78 | RAD52 (0.67) | ALDH1A1KDM4EMEN1KMT2ACHRM2 | |
| SCHEMBL18072532 | 0.78 | CHRM3 (0.53) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL15986885 | 0.77 | F13A1 (0.49) | ALDH1A1NPC1RAB9AMAPTCHRM2 | |
| SCHEMBL211276 | 0.76 | KCNT1 (0.56) | ALDH1A1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL8556919 | 0.76 | NPC1 (0.56) | ALDH1A1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL6846616 | 0.75 | MEN1 (0.47) | ALDH1A1MAPTMEN1KMT2AUSP2 | |
| SCHEMBL16577075 | 0.75 | MEN1 (0.62) | ALDH1A1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL15629359 | 0.75 | CHRM2 (0.50) | ALDH1A1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL209299 | 0.74 | KDM4E (0.61) | ALDH1A1KDM4EKMT2ACHRM2CHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0582164-B1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | BRISTOL MYERS SQUIBB CO (US) | 1998-12-23 | — | — | EP | disclosed |
| EP-0582164-A1 | Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles | Bristol-Myers Squibb Company (US) | 1994-02-09 | — | — | EP | disclosed |