Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20085218 | 0.88 | MAPT (0.46) | ALDH1A1NCF1KMT2APIK3CAALOX15 | |
| SCHEMBL18000190 | 0.79 | ITK (0.51) | ALDH1A1KMT2AALOX15HSD17B10TSHR | |
| SCHEMBL1486903 | 0.78 | PDE3B (0.48) | ALDH1A1KMT2AALOX15HSD17B10HPGD | |
| SCHEMBL18000094 | 0.73 | PIK3CA (0.51) | ALDH1A1NCF1KMT2APIK3CAALOX15 | |
| SCHEMBL18000224 | 0.73 | HSD17B10 (0.44) | ALDH1A1NCF1KMT2APIK3CAALOX15 | |
| SCHEMBL28646855 | 0.71 | MAPT (0.52) | ALDH1A1NCF1KMT2AALOX15HSD17B10 | |
| SCHEMBL12123168 | 0.69 | CYP2A6 (0.56) | ALDH1A1HPGDMAPTLMNAKDM4E | |
| SCHEMBL10997165 | 0.68 | ALDH1A1 (0.44) | ALDH1A1KMT2APIK3CAHSD17B10HPGD | |
| SCHEMBL14319802 | 0.68 | EGFR (0.52) | ALDH1A1NCF1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL23773829 | 0.67 | KMT2A (0.42) | NCF1KMT2AHPGDTSHRNPSR1 |
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-3312172-B1 | AMINOPYRAZOLE DERIVATIVES USEFUL AS SRC KINASE INHIBITORS | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2020-05-06 | — | — | EP | disclosed |
| EP-3312172-A1 | AMINOPYRAZOLE DERIVATIVES | Chugai Seiyaku Kabushiki Kaisha (JP) | 2018-04-25 | — | — | EP | disclosed |