Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 8/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.47 |
| ▸ | NPC1 | O15118 | 6/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.42 |
| ▸ | MITF | O75030 | 2/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.41 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.41 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 5/20 | 0.35 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.35 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.35 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4147199 | 0.82 | RAB9A (0.46) | RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1 | |
| SCHEMBL8281626 | 0.78 | NPC1 (0.60) | RAB9ASMN1; SMN2ALDH1A1NPC1MAPT | |
| SCHEMBL14385181 | 0.76 | RAB9A (0.55) | RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1 | |
| SCHEMBL4498149 | 0.76 | RAB9A (0.55) | RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1 | |
| SCHEMBL4178254 | 0.75 | ALDH1A1 (0.61) | RAB9ASMN1; SMN2L3MBTL1ALDH1A1MAPT | |
| SCHEMBL8598436 | 0.75 | TNF (0.41) | RAB9ASMN1; SMN2ALDH1A1NPC1MAPT | |
| SCHEMBL6370522 | 0.74 | MAPK14 (0.58) | RAB9ANPC1MITFKMT2AMAPK14 | |
| SCHEMBL21521858 | 0.74 | NPBWR1 (0.61) | RAB9ASMN1; SMN2L3MBTL1ALDH1A1HSD17B10 | |
| SCHEMBL6378534 | 0.71 | MAPK14 (0.64) | MAPK14 | |
| SCHEMBL9875402 | 0.67 | TNF (0.40) | RAB9ASMN1; SMN2ALDH1A1NPC1MAPT |
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-1725538-B1 | PYRIDAZINONE UREAS AS ANTAGONISTS OF A4 INTEGRINS | JANSSEN PHARMACEUTICA NV (BE) | 2007-08-29 | — | — | EP | disclosed |
| WO-2005077914-A1 | PYRIDAZINONE UREAS AS ANTAGONISTS OF α4 INTEGRINS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2005-08-25 | — | — | WO | disclosed |