Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 3/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.38 |
| ▸ | AHR | P35869 | 3/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29448818 | 0.82 | ALDH1A1 (0.60) | ALDH1A1KMT2AFAAHABCC9HTR3A | |
| SCHEMBL5618318 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KMT2AFAAHABCC9HTR3A | |
| SCHEMBL1839676 | 0.75 | ALDH1A1 (0.51) | ALDH1A1KMT2AFAAHHTR3ACHRNA7 | |
| Hydrochloric Acid SCHEMBL6996114 | 0.74 | ALDH1A1 (0.49) | ALDH1A1KMT2AFAAHABCC9HTR3A | |
| SCHEMBL6972027 | 0.73 | FAAH (0.51) | FAAHESR1ESR2SMN1; SMN2 | |
| SCHEMBL482377 | 0.72 | IDO1 (0.47) | ALDH1A1KMT2AHTR3ACHRNA7AHR | |
| SCHEMBL1836503 | 0.72 | ALDH1A1 (0.49) | ALDH1A1KMT2AFAAHHTR3ACHRNA7 | |
| SCHEMBL10222158 | 0.72 | ALDH1A1 (0.49) | ALDH1A1KMT2AFAAHHTR3ACHRNA7 | |
| Hydrochloric Acid SCHEMBL5109377 | 0.70 | IDO1 (0.46) | ALDH1A1KMT2AHTR3ACHRNA7AHR | |
| SCHEMBL8114653 | 0.70 | KMT2A (0.56) | ALDH1A1KMT2AFAAHABCC9HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |