Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.46 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.46 |
| ▸ | ALB | P02768 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | RARB | P10826 | 1/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.46 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.46 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14537418 | 0.83 | AKR1C3 (0.56) | PTGS2PTGS1AKR1C3LMNACYP2C9 | |
| SCHEMBL1690400 | 0.83 | AKR1C3 (0.56) | PTGS2PTGS1AKR1C3LMNACYP2C9 | |
| Hydrochloric Acid SCHEMBL8937692 | 0.81 | AKR1C3 (0.54) | PTGS2PTGS1AKR1C3LMNACYP2C9 | |
| SCHEMBL1178369 | 0.81 | CA2 (0.58) | CYP19A1RAB9ASMN1; SMN2CA2 | |
| Hydrochloric Acid SCHEMBL2673007 | 0.79 | CA2 (0.56) | CYP19A1RAB9ASMN1; SMN2CA2 | |
| SCHEMBL9484991 | 0.76 | NAPRT (0.53) | AKR1C3LMNACYP2C9AKR1C2ESR1 | |
| SCHEMBL5509666 | 0.74 | CYP17A1 (0.61) | TSHRCYP19A1RAB9ASMN1; SMN2CA2 | |
| SCHEMBL28156856 | 0.74 | CA2 (0.50) | CYP19A1RAB9ASMN1; SMN2CA2SLC22A12 | |
| SCHEMBL2371076 | 0.74 | EPHX1 (0.53) | PTGS2AKR1C3CYP2C9AKR1C2CYP19A1 | |
| SCHEMBL7767500 | 0.74 | EPHX1 (0.53) | PTGS2AKR1C3CYP2C9AKR1C2CYP19A1 |
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-0525109-A4 | STYRYL-SUBSTITUTED MONOCYCLIC AND BICYCLIC HETEROARYL COMPOUNDS WHICH INHIBIT EGF RECEPTOR TYROSINE KINASE | — | 1993-06-30 | — | — | EP | disclosed |
| EP-0525109-A1 | STYRYL-SUBSTITUTED MONOCYCLIC AND BICYCLIC HETEROARYL COMPOUNDS WHICH INHIBIT EGF RECEPTOR TYROSINE KINASE | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) | 1993-02-03 | — | — | EP | disclosed |