Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.35 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | TKT | P29401 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7785899 | 0.83 | ALDH1A1 (0.38) | SMN1; SMN2ALDH1A1KMT2ACDC7DBF4 | |
| SCHEMBL28064354 | 0.78 | P2RX3 (0.38) | RAB9AALDH1A1MEN1KMT2ATKT | |
| SCHEMBL10584431 | 0.78 | ALDH1A1 (0.42) | SMN1; SMN2NPC1RAB9ANFKB1NFKB2 | |
| SCHEMBL8007427 | 0.78 | KDM4E (0.43) | SMN1; SMN2NPC1RAB9ANFKB1NFKB2 | |
| SCHEMBL5752103 | 0.76 | P2RX3 (0.35) | MEN1KMT2AHSP90AA1TKTKDM4E | |
| SCHEMBL26647420 | 0.76 | AOC3 (0.52) | SMN1; SMN2ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL1964549 | 0.74 | RAB9A (0.52) | SMN1; SMN2NPC1RAB9ANFKB1NFKB2 | |
| SCHEMBL3346336 | 0.73 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2AMAPTCA2 | |
| SCHEMBL7822285 | 0.71 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1MEN1KMT2ACA2 | |
| SCHEMBL9319741 | 0.71 | ALDH1A1 (0.38) | SMN1; SMN2NPC1RAB9ANFKB1NFKB2 |
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-1648890-A2 | ARYL-CONDENSED 3-ARYLPYRIDINE COMPOUNDS AND USE THEREOF FOR CONTROLLING PATHOGENIC FUNGI | BASF AKTIENGESELLSCHAFT (DE) | 2006-04-26 | — | — | EP | disclosed |
| WO-2005010000-A2 | ARYL-CONDENSED 3-ARYLPYRIDINE COMPOUNDS AND USE THEREOF FOR CONTROLLING PATHOGENIC FUNGI | BASF AKTIENGESELLSCHAFT (DE) | 2005-02-03 | — | — | WO | disclosed |