Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.37 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.37 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.37 |
| ▸ | KAT2B | Q92831 | 7/20 | 0.35 |
| ▸ | BRD9 | Q9H8M2 | 4/20 | 0.35 |
| ▸ | BPTF | Q12830 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | BRD1 | O95696 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4498149 | 0.79 | RAB9A (0.55) | ALDH1A1L3MBTL1MTORRAB9ASMN1; SMN2 | |
| SCHEMBL4292263 | 0.70 | NPC1 (0.50) | ALDH1A1MTORRAB9ASMN1; SMN2KAT2B | |
| SCHEMBL23318253 | 0.67 | KAT2B (0.43) | ALDH1A1MTORRAB9ASMN1; SMN2KAT2B | |
| SCHEMBL8281635 | 0.67 | MTOR (0.43) | ALDH1A1MTORRAB9ASMN1; SMN2KAT2B | |
| SCHEMBL17912381 | 0.67 | KAT2B (0.47) | ALDH1A1MTORRAB9AKAT2BBRD9 | |
| SCHEMBL26654733 | 0.67 | CACNA1H (0.39) | — | |
| SCHEMBL26906599 | 0.65 | GAA (0.37) | ALDH1A1BPTFMEN1LMNAKMT2A | |
| SCHEMBL16651209 | 0.64 | BRD4 (0.35) | — | |
| SCHEMBL31644264 | 0.62 | ITGB1 (0.33) | ITGB1ITGA4ITGB7 | |
| SCHEMBL22031949 | 0.62 | KAT2B (0.39) | ALDH1A1L3MBTL1RAB9ASMN1; SMN2ITGB1 |
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-2005077915-A1 | PYRIDAZINONES AS ANTAGONISTS OF A4 INTEGRINS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2005-08-25 | — | — | WO | disclosed |