Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.36 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| SCHEMBL11439324 | 0.83 | CA2 (0.45) | TSHRALDH1A1CA1CA2CA12 | |
| SCHEMBL463746 | 0.83 | CYP1A2 (0.43) | TSHRALDH1A1GAAPDK1PDK2 | |
| SCHEMBL101764 | 0.77 | ALDH1A1 (0.52) | TSHRALDH1A1GAAHPGDHSD17B10 | |
| SCHEMBL11323212 | 0.75 | ALDH1A1 (0.47) | TSHRALDH1A1TTRPDK1PDK2 | |
| SCHEMBL11663384 | 0.74 | GAA (0.52) | ALDH1A1GAAPDK1PDK2PDK3 | |
| SCHEMBL1952571 | 0.74 | IDO1 (0.43) | ALDH1A1GAACA1CA2CA12 | |
| SCHEMBL10814735 | 0.74 | TRPA1 (0.52) | TSHRALDH1A1GAACA1CA2 | |
| SCHEMBL3792624 | 0.74 | RAPGEF4 (0.40) | TSHRALDH1A1TTRGAAEGFR | |
| SCHEMBL5512079 | 0.73 | PDE4D (0.38) | ALDH1A1GAACA1CA2CA12 | |
| SCHEMBL21290593 | 0.73 | ADRA2A (0.37) | TSHRALDH1A1TTRGAAPDK1 |
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-3981717-A | ANILINO COMPOUNDS | AMERICAN CYANAMID COMPANY (US) | 1976-09-21 | — | — | US | disclosed |