Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | CFTR | P13569 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.45 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.45 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1162462 | 0.88 | ALDH1A1 (0.60) | SLC6A3ALDH1A1LMNABCAT2TSHR | |
| SCHEMBL25143785 | 0.86 | SLC6A3 (0.54) | SLC6A3SLC6A4ALDH1A1LMNASLC6A2 | |
| SCHEMBL9301375 | 0.85 | SLC6A3 (0.57) | SLC6A3SLC6A4ALDH1A1LMNASLC6A2 | |
| SCHEMBL69464 | 0.84 | SLC6A3 (0.67) | SLC6A3SLC6A4ALDH1A1LMNASLC6A2 | |
| SCHEMBL5284224 | 0.83 | ALDH1A1 (0.55) | SLC6A3SLC6A4ALDH1A1LMNASLC6A2 | |
| SCHEMBL3959092 | 0.83 | ALDH1A1 (0.51) | SLC6A3SLC6A4ALDH1A1LMNASLC6A2 | |
| SCHEMBL7827157 | 0.82 | AKR1B1 (0.67) | LMNABCAT2TSHRAKR1B1MAPT | |
| SCHEMBL6437163 | 0.80 | SLC6A3 (0.59) | SLC6A3SLC6A4ALDH1A1LMNASLC6A2 | |
| SCHEMBL7170821 | 0.80 | ALDH1A1 (0.49) | SLC6A3SLC6A4ALDH1A1LMNASLC6A2 | |
| SCHEMBL8172682 | 0.80 | SMN1; SMN2 (0.48) | ALDH1A1LMNABCAT2TSHRCFTR |
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-6576632-B1 | Such as 3'-((Benzyl-(2-benzyl-1,2,3,4-tetrahydro-naphthalen-1-yl)-carbamoyl)-methyl)-biphenyl-3-carboxylic acid | PFIZER INC | 2003-06-10 | — | — | US | disclosed |