Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCKDK | O14874 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.45 |
| ▸ | TLR3 | O15455 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | GPER1 | Q99527 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL16862081 | 0.87 | BCKDK (0.56) | BCKDKKDM4ELMNAALDH1A1RECQL | |
| SCHEMBL19283514 | 0.84 | MCL1 (0.59) | BCKDKKDM4ELMNAALDH1A1RAB9A | |
| SCHEMBL5237770 | 0.78 | MCL1 (0.57) | KDM4ELMNAALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL5234250 | 0.77 | MAPT (0.56) | BCKDKKDM4ELMNAALDH1A1RAB9A | |
| SCHEMBL594468 | 0.76 | BCKDK (1.00) | BCKDKKDM4ELMNAALDH1A1RECQL | |
| SCHEMBL2610278 | 0.75 | BCKDK (0.74) | BCKDKKDM4ELMNAALDH1A1RECQL | |
| SCHEMBL693146 | 0.75 | BCKDK (0.68) | BCKDKKDM4ELMNAALDH1A1RECQL | |
| SCHEMBL2279755 | 0.73 | BCKDK (0.77) | BCKDKKDM4ELMNAALDH1A1RECQL | |
| SCHEMBL9203348 | 0.73 | MCL1 (0.57) | BCKDKKDM4ELMNAALDH1A1RAB9A | |
| SCHEMBL18187797 | 0.73 | BCKDK (0.61) | BCKDKKDM4ELMNAALDH1A1RECQL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1461335-B1 | 2-HETEROARYLCARBOXYLIC ACID AMIDES | BAYER HEALTHCARE AG (DE) | 2007-02-28 | — | — | EP | disclosed |
| EP-1461335-A1 | 2-HETEROARYLCARBOXYLIC ACID AMIDES | Bayer HealthCare AG (DE) | 2004-09-29 | — | — | EP | disclosed |
| WO-2003055878-A1 | 2-HETEROARYLCARBOXYLIC ACID AMIDES | BAYER HEALTHCARE AG (DE) | 2003-07-10 | — | — | WO | disclosed |