Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | PTPRC | P08575 | 1/20 | 0.37 |
| ▸ | S100A4 | P26447 | 1/20 | 0.37 |
| ▸ | EIF4E | P06730 | 1/20 | 0.37 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.36 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11842494 | 0.80 | ALDH1A1 (0.62) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR | |
| SCHEMBL11672909 | 0.79 | ALDH1A1 (0.60) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR | |
| SCHEMBL11790626 | 0.79 | ALDH1A1 (0.60) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR | |
| SCHEMBL11839239 | 0.77 | CYP2A6 (0.47) | TDP1MEN1KMT2A | |
| Bicarbonate SCHEMBL27502524 | 0.76 | ALDH1A1 (0.88) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR | |
| SCHEMBL2958562 | 0.74 | ALDH1A1 (0.92) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR | |
| SCHEMBL14494913 | 0.74 | ALDH1A1 (0.61) | ALDH1A1TDP1ADAMTS4CYP1A2PTPN1 | |
| SCHEMBL11830726 | 0.74 | ALDH1A1 (0.53) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR | |
| SCHEMBL30196067 | 0.74 | ALDH1A1 (1.00) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR | |
| SCHEMBL44392 | 0.74 | ALDH1A1 (1.00) | ALDH1A1TDP1ADAMTS4CYP1A2TSHR |
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 |