Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 12/20 | 0.34 |
| ▸ | JUN | P05412 | 5/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 5/20 | 0.34 |
| ▸ | RELA | Q04206 | 5/20 | 0.34 |
| ▸ | STK17B | O94768 | 1/20 | 0.33 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.33 |
| ▸ | ATF1 | P18846 | 8/20 | 0.32 |
| ▸ | XPO1 | O14980 | 4/20 | 0.32 |
| ▸ | CHUK | O15111 | 1/20 | 0.31 |
| ▸ | BCL6 | P41182 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL15250870 | 0.79 | NPC1 (0.34) | NPC1MAPTRAB9AKMT2ANFKB1 | |
| SCHEMBL4549880 | 0.73 | CSNK1A1 (0.35) | — | |
| SCHEMBL15249192 | 0.66 | NPC1 (0.34) | NPC1MAPTRAB9AKMT2ANFKB1 | |
| SCHEMBL17373087 | 0.64 | NFKB1 (0.46) | NPC1MAPTRAB9AKMT2ANFKB1 | |
| SCHEMBL31278674 | 0.62 | CYP2C9 (0.40) | NFKB1JUNNFKB2RELAATF1 | |
| SCHEMBL14441484 | 0.60 | HTT (0.33) | MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL29076150 | 0.59 | STK17B (0.44) | NFKB1JUNNFKB2RELASTK17B | |
| SCHEMBL25205003 | 0.59 | PTK2 (0.44) | NFKB1JUNNFKB2RELAATF1 | |
| SCHEMBL18476604 | 0.59 | STK17B (0.31) | STK17BSTK17A | |
| SCHEMBL30135451 | 0.59 | JUN (0.33) | NFKB1JUNNFKB2RELA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012061156-A1 | CDK INHIBITORS | TAVARES FRANCIS X (US) | 2012-05-10 | — | — | WO | disclosed |