Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 3/20 | 0.37 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | CHRNB3 | Q05901 | 2/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21301017 | 0.90 | CRHR1 (0.40) | CRHR1ACHECHRNB1CHRNB2CHRNB4 | |
| SCHEMBL17400676 | 0.90 | CRHR1 (0.40) | CRHR1ACHECHRNB1CHRNB2CHRNB4 | |
| SCHEMBL21301033 | 0.90 | CRHR1 (0.42) | CRHR1ACHETRPV4ALDH1A1KMT2A | |
| SCHEMBL18724088 | 0.88 | CRHR1 (0.40) | CRHR1ACHECHRNB1CHRNB2CHRNB4 | |
| SCHEMBL21005959 | 0.85 | MEN1 (0.47) | CRHR1TRPV4ALDH1A1MEN1KMT2A | |
| SCHEMBL18724252 | 0.85 | MEN1 (0.47) | CRHR1TRPV4ALDH1A1MEN1KMT2A | |
| SCHEMBL21301054 | 0.83 | CRHR1 (0.39) | CRHR1TRPV4ALDH1A1MEN1KMT2A | |
| SCHEMBL18724210 | 0.82 | MAPK1 (0.42) | CRHR1ACHEALDH1A1MAPK1MAPT | |
| SCHEMBL21301073 | 0.79 | MAPK1 (0.43) | CRHR1ALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL17412696 | 0.79 | TRPV4 (0.43) | CRHR1ACHETRPV4ALDH1A1MAPT |
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-2963036-B1 | 2-ACYLAMINOTHIAZOLE DERIVATIVE AND SALT THEREOF | ASTELLAS PHARMA INC (JP) | 2019-08-28 | — | — | EP | disclosed |