Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.39 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.39 |
| ▸ | ALB | P02768 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11837707 | 0.85 | ALDH1A1 (0.47) | TSHRALDH1A1NPC1RAB9APTGS1 | |
| SCHEMBL11835552 | 0.82 | PPARG (0.47) | ALDH1A1L3MBTL1PPARGPPARAHPGD | |
| SCHEMBL11826787 | 0.82 | ALDH1A1 (0.47) | TSHRALDH1A1AKR1C3CYP2C9AKR1C2 | |
| SCHEMBL11828893 | 0.79 | ALDH1A1 (0.61) | ALDH1A1NPC1RAB9ARARBHPGD | |
| SCHEMBL11823101 | 0.79 | PTGS2 (0.54) | TSHRPTGS1PTGS2AKR1C3LMNA | |
| SCHEMBL11827938 | 0.78 | FFAR1 (0.45) | ALDH1A1TDP1L3MBTL1PPARGPPARA | |
| SCHEMBL11837564 | 0.78 | ALDH1A1 (0.62) | ALDH1A1PTGS1PTGS2LMNAESR1 | |
| SCHEMBL8681618 | 0.77 | ALDH1A1 (0.54) | TSHRALDH1A1NPC1RAB9ANPSR1 | |
| SCHEMBL9492547 | 0.76 | PPARG (0.51) | PPARGPPARAHSD17B10 | |
| SCHEMBL10174246 | 0.76 | ALDH1A1 (0.57) | TSHRALDH1A1NPC1RAB9ANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3966801-A | ANTIINFLAMMATORY AGENTS | WILLIAM H. RORER, INC. (US) | 1976-06-29 | — | — | US | disclosed |