Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 10/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 5/20 | 0.37 |
| ▸ | EED | O75530 | 1/20 | 0.37 |
| ▸ | RBBP4 | Q09028 | 1/20 | 0.37 |
| ▸ | SUZ12 | Q15022 | 1/20 | 0.37 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.37 |
| ▸ | AEBP2 | Q6ZN18 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 3/20 | 0.36 |
| ▸ | MMP3 | P08254 | 3/20 | 0.36 |
| ▸ | MMP7 | P09237 | 3/20 | 0.36 |
| ▸ | MMP9 | P14780 | 3/20 | 0.36 |
| ▸ | MMP8 | P22894 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12892140 | 0.91 | NPC1 (0.41) | NPC1RAB9AGPR119DPP4MMP13 | |
| SCHEMBL8345088 | 0.81 | ITGB3 (0.48) | NPC1RAB9AGPR119ITGB3ITGAV | |
| SCHEMBL8344058 | 0.81 | GPR119 (0.42) | GPR119MMP13ITGB3ITGAVITGA2B | |
| SCHEMBL8346388 | 0.75 | GPR119 (0.43) | NPC1RAB9AGPR119DPP4ALDH1A1 | |
| SCHEMBL13855089 | 0.75 | ITGB3 (0.56) | NPC1RAB9AGPR119ITGB3ITGAV | |
| SCHEMBL10154213 | 0.74 | P2RX7 (0.36) | NPC1RAB9AALDH1A1MAPTITGB3 | |
| SCHEMBL12892122 | 0.71 | ITGB3 (0.45) | NPC1RAB9AGPR119MMP13EED | |
| SCHEMBL8345087 | 0.68 | GPR119 (0.47) | NPC1RAB9AGPR119MMP13ALDH1A1 | |
| SCHEMBL8030519 | 0.68 | ITGB3 (0.44) | GPR119MMP13ITGB3ITGAVITGA2B | |
| SCHEMBL13591240 | 0.66 | ALDH1A1 (0.51) | NPC1RAB9AGPR119ALDH1A1MAPT |
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-1539739-B1 | PIPERIDINYL COMPOUNDS THAT SELECTIVELY BIND INTEGRINS | JANSSEN PHARMACEUTICA NV (BE) | 2010-11-24 | — | — | EP | disclosed |
| WO-2004020435-A1 | PIPERIDINYL COMPOUNDS THAT SELECTIVELY BIND INTEGRINS | JANSSEN PHARMACEUTICA N.V. (BE) | 2004-03-11 | — | — | WO | disclosed |