Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.62 |
| ▸ | HMGCR | P04035 | 1/20 | 0.62 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.62 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.62 |
| ▸ | PDE4A | P27815 | 1/20 | 0.62 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.62 |
| ▸ | GCGR | P47871 | 19/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL7561153 | 1.00 | ESR1 (0.62) | ESR1HMGCRCHRM1TBXA2RPDE4A | |
| SCHEMBL8953459 | 0.90 | ESR1 (0.52) | ESR1HMGCRCHRM1TBXA2RPDE4A | |
| SCHEMBL9745042 | 0.90 | ESR1 (0.52) | ESR1HMGCRCHRM1TBXA2RPDE4A | |
| SCHEMBL9745047 | 0.90 | ESR1 (0.52) | ESR1HMGCRCHRM1TBXA2RPDE4A | |
| SCHEMBL9153492 | 0.90 | ESR1 (0.52) | ESR1HMGCRCHRM1TBXA2RPDE4A | |
| SCHEMBL9744292 | 0.88 | ESR1 (0.51) | ESR1HMGCRCHRM1TBXA2RPDE4A | |
| SCHEMBL9744297 | 0.88 | ESR1 (0.51) | ESR1HMGCRCHRM1TBXA2RPDE4A | |
| SCHEMBL9744468 | 0.88 | GCGR (0.54) | ESR1HMGCRCHRM1TBXA2RPDE4A | |
| SCHEMBL9744458 | 0.88 | GCGR (0.54) | ESR1HMGCRCHRM1TBXA2RPDE4A | |
| SCHEMBL7077308 | 0.88 | GCGR (0.67) | ESR1HMGCRCHRM1TBXA2RPDE4A |
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 |
|---|---|---|---|---|---|---|---|
| JP-8073432-A | — | — | None | — | — | JP | disclosed |
| JP-H0873432-A | PRODUCTION OF OPTICALLY ACTIVE 7-SUBSTITUTED-PYRIDYL-3,5-DIHYDROXY-HEPT-6-ENOIC ACID ESTER DERIVATIVE | UBE IND LTD | 1996-03-19 | — | — | JP | disclosed |