Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | WDR5 | P61964 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | CXCR3 | P49682 | 6/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12515553 | 0.92 | MEN1 (0.52) | KMT2AMEN1WDR5GAACXCR3 | |
| SCHEMBL2221639 | 0.89 | KMT2A (0.60) | KMT2AMEN1WDR5GAACXCR3 | |
| SCHEMBL2222665 | 0.87 | MEN1 (0.56) | KMT2AMEN1WDR5GAACXCR3 | |
| SCHEMBL2222754 | 0.86 | KMT2A (0.52) | KMT2AMEN1WDR5GAACXCR3 | |
| SCHEMBL2221503 | 0.85 | MEN1 (0.56) | KMT2AMEN1WDR5GAACXCR3 | |
| SCHEMBL2221486 | 0.85 | MEN1 (0.72) | KMT2AMEN1GAACXCR3MAPT | |
| SCHEMBL2221797 | 0.85 | KMT2A (0.53) | KMT2AMEN1WDR5GAACXCR3 | |
| SCHEMBL2220801 | 0.85 | WDR5 (0.54) | KMT2AMEN1WDR5GAACXCR3 | |
| SCHEMBL2222538 | 0.85 | MEN1 (0.55) | KMT2AMEN1WDR5GAACXCR3 | |
| SCHEMBL2221554 | 0.85 | MEN1 (0.55) | KMT2AMEN1WDR5GAACXCR3 |
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-2011084985-A1 | CXCR3 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-07-14 | — | — | WO | claimed |