Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | APOB | P04114 | 3/20 | 0.44 |
| ▸ | MTTP | P55157 | 3/20 | 0.44 |
| ▸ | KLRK1 | P26718 | 4/20 | 0.43 |
| ▸ | MICA | Q29983 | 4/20 | 0.43 |
| ▸ | RAET1L | Q5VY80 | 3/20 | 0.43 |
| ▸ | TACR1 | P25103 | 2/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CHUK | O15111 | 1/20 | 0.39 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL171542 | 0.83 | TRPV1 (0.54) | KIF11BACE1GAAAPOBMTTP | |
| SCHEMBL1588207 | 0.79 | BCAT2 (0.52) | BACE1GAAALDH1A1POLBHSD17B10 | |
| SCHEMBL29066698 | 0.78 | SMN1; SMN2 (0.39) | ALDH1A1MAOB | |
| SCHEMBL10492731 | 0.78 | KMT2A (0.40) | GAAALDH1A1POLB | |
| Xenalipin SCHEMBL29881739 | 0.77 | CYP2C8 (0.58) | KIF11BACE1GAAAPOBMTTP | |
| Xenalipin SCHEMBL133087 | 0.77 | CYP2C8 (0.58) | KIF11BACE1GAAAPOBMTTP | |
| SCHEMBL17840160 | 0.77 | KIF11 (0.68) | KIF11BACE1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL2564888 | 0.76 | BCAT2 (0.65) | KIF11BACE1GAAKLRK1MICA | |
| SCHEMBL8341064 | 0.76 | KIF11 (0.47) | KIF11BACE1GAAKLRK1MICA | |
| SCHEMBL403609 | 0.76 | GAA (0.51) | KIF11BACE1GAAAPOBMTTP |
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 |
|---|---|---|---|---|---|---|---|
| EP-1694644-B1 | N-ARYL PIPERIDINE SUBSTITUTED BIPHENYLCARBOXAMIDES AS INHIBITORS OF APOLIPOPROTEIN B | JANSSEN PHARMACEUTICA NV (BE) | 2012-03-07 | — | — | EP | disclosed |