Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.42 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CHIT1 | Q13231 | 1/20 | 0.40 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1031721 | 0.89 | ALDH1A1 (0.55) | ALDH1A1MAPK8LMNARAB9AMAPK1 | |
| SCHEMBL29639794 | 0.89 | ALDH1A1 (0.55) | ALDH1A1MAPK8LMNARAB9AMAPK1 | |
| Hydrochloric Acid SCHEMBL4080936 | 0.87 | ALDH1A1 (0.53) | ALDH1A1MAPK8LMNARAB9AMAPK1 | |
| Trifluoroacetic Acid SCHEMBL5658268 | 0.81 | CTBP2 (0.49) | ALDH1A1MAPK8CES1TAAR1MEN1 | |
| Trifluoroacetic Acid SCHEMBL5658062 | 0.81 | PKM (0.51) | MAPK8LMNARAB9APTGS2 | |
| Trifluoroacetic Acid SCHEMBL27625600 | 0.80 | KMT2A (0.47) | LMNARAB9ACES1KMT2A | |
| Trifluoroacetic Acid SCHEMBL29921868 | 0.79 | TDP1 (0.60) | MAPK8LMNAPARP10MEN1KMT2A | |
| Trifluoroacetic Acid SCHEMBL5892868 | 0.78 | CES1 (0.62) | CES1MEN1KMT2ACA2 | |
| Trifluoroacetic Acid SCHEMBL5076869 | 0.78 | SMN1; SMN2 (0.53) | MAPK8LMNARAB9ATAAR1MEN1 | |
| Trifluoroacetic Acid SCHEMBL7868984 | 0.77 | SCN3A (0.50) | ALDH1A1LMNATAAR1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7309701-B2 | Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2007-12-18 | — | — | US | disclosed |