Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.41 |
| ▸ | TNK2 | Q07912 | 6/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.34 |
| ▸ | MELK | Q14680 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.33 |
| ▸ | BRD9 | Q9H8M2 | 3/20 | 0.32 |
| ▸ | BRD4 | O60885 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11946091 | 0.85 | ATR (0.33) | ATRALDH1A1LMNAPOLB | |
| SCHEMBL11944514 | 0.80 | HPGD (0.38) | ALDH1A1LMNAPOLBSMN1; SMN2HSD17B10 | |
| SCHEMBL14899776 | 0.75 | ADRA2C (0.48) | HRH4LMNAPOLBKMT2ASMN1; SMN2 | |
| SCHEMBL14899749 | 0.75 | SMN1; SMN2 (0.45) | HRH4ALDH1A1LMNAPOLBKMT2A | |
| SCHEMBL14899753 | 0.74 | SMN1; SMN2 (0.48) | ALDH1A1LMNAPOLBKMT2ASMN1; SMN2 | |
| SCHEMBL11944199 | 0.73 | ALDH1A1 (0.44) | ALDH1A1LMNAPOLBKMT2ASMN1; SMN2 | |
| SCHEMBL14899736 | 0.73 | NCF1 (0.50) | TNK2SRCHRH4LMNAPOLB | |
| SCHEMBL11944264 | 0.72 | ALDH1A1 (0.43) | ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL30268685 | 0.72 | RAB9A (0.44) | ATRALDH1A1LMNAPOLBKMT2A | |
| SCHEMBL11944212 | 0.72 | ALDH1A1 (0.43) | ALDH1A1LMNAKMT2ASMN1; SMN2 |
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-2137179-B1 | PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS | MERCK SHARP & DOHME (US) | 2015-09-02 | — | — | EP | disclosed |