Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6731717 | 0.72 | NR3C1 (0.36) | CYP2C19LMNAMAPTNPC1RAB9A | |
| SCHEMBL7674920 | 0.70 | CYP2C19 (0.51) | CYP2C19NR1H4SLC22A12LMNAMAPT | |
| SCHEMBL7817806 | 0.69 | KMT2A (0.51) | CYP2C19LMNAMAPTPOLBNCOA1 | |
| SCHEMBL7670073 | 0.66 | TPMT (0.65) | CYP2C19LMNATSHRNCOA1NCOA3 | |
| SCHEMBL6740976 | 0.65 | NUDT1 (0.38) | ESR1TP53POLBESR2SMN1; SMN2 | |
| SCHEMBL24199843 | 0.62 | MAPT (0.51) | CYP2C19MAPTL3MBTL1TP53POLB | |
| SCHEMBL21362509 | 0.61 | MAPT (0.45) | CYP2C19SLC22A12MAPTTP53HPGD | |
| SCHEMBL24199867 | 0.61 | HTT (0.45) | CYP2C19SLC22A12LMNAMAPTTP53 | |
| SCHEMBL6736525 | 0.61 | CYP2C19 (0.46) | CYP2C19NR1H4LMNAMAPTPOLB | |
| SCHEMBL7670596 | 0.61 | CYP2C19 (0.53) | CYP2C19NR1H4SLC22A12LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1077968-A1 | NAPHTHO[2,3-B]HETEROAR-4-YL DERIVATIVES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999058522-A1 | NAPHTHO[2,3-B]HETEROAR-4-YL DERIVATIVES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-11-18 | — | — | WO | disclosed |