Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 13/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9239262 | 0.90 | SMN1; SMN2 (0.46) | SMN1; SMN2LMNAMRGPRX4NPC1RAB9A | |
| SCHEMBL10933551 | 0.87 | ATM (0.50) | SMN1; SMN2LMNANPC1RAB9AALDH1A1 | |
| SCHEMBL15596803 | 0.86 | MRGPRX4 (0.53) | SMN1; SMN2LMNAMRGPRX4NPC1RAB9A | |
| SCHEMBL9238687 | 0.82 | NPC1 (0.57) | SMN1; SMN2LMNAMRGPRX4NPC1RAB9A | |
| SCHEMBL15567210 | 0.82 | SMN1; SMN2 (0.53) | SMN1; SMN2LMNAMRGPRX4NPC1RAB9A | |
| SCHEMBL9239206 | 0.82 | MAPK14 (0.44) | SMN1; SMN2LMNANPC1RAB9AALDH1A1 | |
| SCHEMBL9232303 | 0.80 | SMN1; SMN2 (0.53) | SMN1; SMN2LMNAMRGPRX4NPC1RAB9A | |
| SCHEMBL15566119 | 0.80 | SMN1; SMN2 (0.53) | SMN1; SMN2LMNAMRGPRX4NPC1RAB9A | |
| SCHEMBL9233810 | 0.80 | SMN1; SMN2 (0.54) | SMN1; SMN2LMNANPC1RAB9AKMT2A | |
| SCHEMBL9237673 | 0.79 | SMN1; SMN2 (0.52) | SMN1; SMN2LMNAMRGPRX4NPC1RAB9A |
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-0665223-A1 | Antitumor agent, novel 3(2H)-pyridazinone derivatives and their preparation | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-08-02 | — | — | EP | disclosed |