Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.71 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.71 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.64 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.64 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.64 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.64 |
| ▸ | ALB | P02768 | 1/20 | 0.64 |
| ▸ | ESR1 | P03372 | 1/20 | 0.64 |
| ▸ | RARB | P10826 | 1/20 | 0.64 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.64 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.64 |
| ▸ | HTR2A | P28223 | 1/20 | 0.64 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.64 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.64 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.64 |
| ▸ | BLM | P54132 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| Butibufen SCHEMBL7346774 | 0.84 | PTGS1 (0.73) | PTGS1PTGS2ALOX5LMNACYP2C9 | |
| Butibufen SCHEMBL24177 | 0.84 | PTGS1 (0.73) | PTGS1PTGS2ALOX5LMNACYP2C9 | |
| SCHEMBL8813286 | 0.83 | PTGS1 (0.71) | PTGS1PTGS2ALOX5LMNACYP2C9 | |
| SCHEMBL27810576 | 0.83 | PTGS1 (1.00) | PTGS1PTGS2ALOX5LMNACYP2C9 | |
| Butibufen SCHEMBL1605646 | 0.83 | PTGS1 (0.71) | PTGS1PTGS2ALOX5LMNACYP2C9 | |
| SCHEMBL27810577 | 0.83 | PTGS1 (1.00) | PTGS1PTGS2ALOX5LMNACYP2C9 | |
| SCHEMBL9474541 | 0.83 | PTGS1 (0.71) | PTGS1PTGS2ALOX5LMNACYP2C9 | |
| SCHEMBL11260212 | 0.82 | CYP2C9 (0.59) | PTGS1PTGS2ALOX5LMNACYP2C9 | |
| SCHEMBL27934588 | 0.81 | PTGS1 (0.69) | PTGS1PTGS2ALOX5LMNACYP2C9 | |
| Ibuprofen SCHEMBL15009054 | 0.81 | PTGS1 (0.89) | PTGS1PTGS2ALOX5LMNACYP2C9 |
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-6072900-A | — | — | None | — | — | JP | disclosed |
| JP-H0672900-A | METHOD FOR DEHALOGENATING HALOGEN COMPOUND | SNOW BRAND MILK PROD CO LTD | 1994-03-15 | — | — | JP | disclosed |