Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | FAAH | O00519 | 8/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL473103 | 0.80 | TDP1 (0.55) | CYP1A2CYP2C19SMN1; SMN2TDP1TSHR | |
| SCHEMBL6232571 | 0.76 | RIPK1 (0.50) | TSHRRIPK1ALDH1A1RAB9ALMNA | |
| SCHEMBL9937386 | 0.76 | SMN1; SMN2 (0.47) | CYP1A2CYP2C19SMN1; SMN2TDP1TSHR | |
| SCHEMBL21659413 | 0.76 | L3MBTL1 (0.50) | SMN1; SMN2FAAHTDP1TSHRL3MBTL1 | |
| SCHEMBL474570 | 0.75 | SMN1; SMN2 (0.53) | CYP1A2CYP2C19SMN1; SMN2TDP1TSHR | |
| SCHEMBL5503388 | 0.74 | CTSK (0.48) | SMN1; SMN2TDP1RAB9ALMNANPC1 | |
| SCHEMBL10415979 | 0.74 | SMN1; SMN2 (0.66) | CYP1A2CYP2C19SMN1; SMN2FAAHTDP1 | |
| SCHEMBL1625209 | 0.74 | GAA (0.71) | CYP1A2CYP2C19SMN1; SMN2TDP1TSHR | |
| SCHEMBL5177894 | 0.74 | CTSK (0.48) | SMN1; SMN2FAAHTDP1ALDH1A1RAB9A | |
| SCHEMBL4704457 | 0.73 | L3MBTL1 (0.44) | CYP1A2CYP2C19SMN1; SMN2TDP1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0790996-A1 | PYRIDAZINOQUINOLINE COMPOUNDS | ZENECA LIMITED (GB) | 1997-08-27 | — | — | EP | disclosed |
| EP-0724583-A1 | PYRIDAZINO QUINOLINE COMPOUNDS | ZENECA LIMITED (GB) | 1996-08-07 | — | — | EP | disclosed |
| WO-1996015127-A1 | PYRIDAZINOQUINOLINE COMPOUNDS | ZENECA LIMITED (GB) | 1996-05-23 | — | — | WO | disclosed |