Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 13/20 | 0.50 |
| ▸ | CASP5 | P51878 | 13/20 | 0.50 |
| ▸ | CASP4 | P49662 | 11/20 | 0.50 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | KMT5A | Q9NQR1 | 1/20 | 0.43 |
| ▸ | GBA1 | P04062 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9689097 | 0.91 | CASP1 (0.58) | CASP1CASP5CASP4HRH4 | |
| SCHEMBL9688138 | 0.91 | CASP1 (0.58) | CASP1CASP5CASP4HRH4 | |
| SCHEMBL9689057 | 0.91 | CASP1 (0.50) | CASP1CASP5CASP4HRH4KMT5A | |
| Hydrochloric Acid SCHEMBL9688259 | 0.90 | CASP1 (0.56) | CASP1CASP5CASP4HRH4 | |
| SCHEMBL9689589 | 0.84 | CASP1 (0.47) | CASP1CASP5CASP4HRH4KMT5A | |
| SCHEMBL9689044 | 0.82 | CASP1 (0.49) | CASP1CASP5CASP4HRH4KMT5A | |
| SCHEMBL10365266 | 0.82 | CASP1 (0.71) | CASP1CASP5CASP4GBA1 | |
| SCHEMBL9690413 | 0.81 | CASP1 (0.58) | CASP1CASP5CASP4HRH4KMT5A | |
| SCHEMBL9133699 | 0.81 | CASP1 (0.58) | CASP1CASP5CASP4HRH4KMT5A | |
| SCHEMBL9689152 | 0.81 | CASP1 (0.58) | CASP1CASP5CASP4HRH4KMT5A |
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-0487510-A1 | Pharmaceutically active amines | THE UPJOHN COMPANY (US) | 1992-05-27 | — | — | EP | disclosed |