Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TLR4 | O00206 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9757951 | 0.96 | NAAA (0.35) | ALDH1A1TLR4SMN1; SMN2TSHRLMNA | |
| SCHEMBL9758171 | 0.95 | NAAA (0.37) | ALDH1A1SMN1; SMN2TSHRLMNAMAPT | |
| SCHEMBL9759586 | 0.95 | NAAA (0.37) | ALDH1A1SMN1; SMN2TSHRLMNAMAPT | |
| SCHEMBL9757982 | 0.94 | MAPT (0.37) | ALDH1A1SMN1; SMN2ATMTSHRTDP1 | |
| SCHEMBL9757935 | 0.93 | PKM (0.36) | ALDH1A1SMN1; SMN2ATMMAPTHPGD | |
| SCHEMBL9758977 | 0.92 | TLR4 (0.36) | ALDH1A1TLR4TSHRLMNAMAPT | |
| SCHEMBL9758550 | 0.90 | NAAA (0.37) | TSHRMAPTHTTCYP2C9 | |
| SCHEMBL9759148 | 0.90 | MAPT (0.36) | TSHRLMNAMAPTHPGDHTT | |
| SCHEMBL9757950 | 0.90 | MAPT (0.38) | LMNAMAPTHPGDHTTCYP2C9 | |
| SCHEMBL9759139 | 0.89 | NAAA (0.37) | ALDH1A1SMN1; SMN2TSHRLMNAMAPT |
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-4985583-A | Liquid Crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-15 | — | — | US | disclosed |