Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | DHODH | Q02127 | 2/20 | 0.39 |
| ▸ | CDC25B | P30305 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | MME | P08473 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | PRKCA | P17252 | 1/20 | 0.35 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11841294 | 0.87 | KDM4E (0.39) | ALDH1A1DHODHCYP2A6AKR1C3AKR1C2 | |
| SCHEMBL11849223 | 0.84 | PGR (0.44) | ALDH1A1DHODHMMECYP2A6AKR1C3 | |
| SCHEMBL11840116 | 0.82 | CYP2A6 (0.44) | DHODHHCAR2MMECYP2A6AKR1C3 | |
| SCHEMBL11838614 | 0.82 | PPARA (0.40) | ELANEALDH1A1CDC25BHCAR2PDK1 | |
| SCHEMBL11835181 | 0.78 | KDM4E (0.37) | ALDH1A1DHODHCYP2A6AKR1C3AKR1C2 | |
| SCHEMBL10363262 | 0.76 | ALDH1A1 (0.59) | ELANEALDH1A1DHODHHCAR2MME | |
| SCHEMBL11840658 | 0.74 | KDM4E (0.40) | ALDH1A1DHODHMMECYP2A6AKR1C3 | |
| SCHEMBL1768331 | 0.74 | ELANE (0.44) | ELANEALDH1A1DHODHAKR1C3AKR1C2 | |
| SCHEMBL11835187 | 0.74 | KDM4E (0.36) | ALDH1A1DHODHHCAR2LMNA | |
| SCHEMBL11099441 | 0.73 | KMT2A (0.63) | ALDH1A1CYP2A6PTGER1LMNA |
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-3941821-A | ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETICS | WILLIAM H. RORER, INC. (US) | 1976-03-02 | — | — | US | disclosed |