Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 5/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9458305 | 1.00 | ALDH1A1 (0.57) | ALDH1A1TSHRKDM4EKMT2AL3MBTL1 | |
| SCHEMBL9458329 | 0.98 | ALDH1A1 (0.55) | ALDH1A1TSHRKDM4EKMT2AL3MBTL1 | |
| SCHEMBL9458672 | 0.94 | TSHR (0.50) | ALDH1A1TSHRKDM4EKMT2AL3MBTL1 | |
| SCHEMBL9698645 | 0.93 | ALDH1A1 (0.51) | ALDH1A1TSHRKDM4EKMT2AL3MBTL1 | |
| SCHEMBL6933481 | 0.93 | ALDH1A1 (0.51) | ALDH1A1TSHRKDM4EKMT2AL3MBTL1 | |
| SCHEMBL6874926 | 0.92 | ALDH1A1 (0.50) | ALDH1A1TSHRKDM4EKMT2AL3MBTL1 | |
| SCHEMBL9799464 | 0.91 | THRA (0.56) | ALDH1A1TSHRTHRA | |
| SCHEMBL1704751 | 0.89 | ALDH1A1 (0.64) | ALDH1A1TSHRKDM4EKMT2AL3MBTL1 | |
| SCHEMBL9458991 | 0.88 | TSHR (0.46) | ALDH1A1TSHRKMT2AL3MBTL1 | |
| SCHEMBL3781252 | 0.87 | ALDH1A1 (0.62) | ALDH1A1KDM4EKMT2AL3MBTL1MAPT |
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-5230828-A | NAPHTHALENEDICARBOXYLIC ACID ESTERS | HOFFMANN-LA ROCHE INC. (US) | 1993-07-27 | — | — | US | disclosed |