Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | CASP1 | P29466 | 4/20 | 0.43 |
| ▸ | CASP7 | P55210 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.43 |
| ▸ | CBFB | Q13951 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20975373 | 0.85 | KDM4E (0.46) | NCF1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL6529865 | 0.82 | PDE10A (0.50) | NCF1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL21335097 | 0.81 | KDM4E (0.40) | KDM4EALDH1A1KMT2AMEN1CASP1 | |
| SCHEMBL16416202 | 0.70 | HTR6 (0.63) | NCF1PDE10ATP53CYP1A2CYP3A4 | |
| SCHEMBL12495116 | 0.70 | HTR2C (0.39) | KDM4EALDH1A1HPGDSMN1; SMN2TAAR1 | |
| SCHEMBL1222766 | 0.69 | CYP1A2 (0.76) | NCF1KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL20975374 | 0.68 | PDE10A (0.44) | NCF1KDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL5133305 | 0.67 | MEN1 (0.51) | KDM4EALDH1A1HPGDSMN1; SMN2KMT2A | |
| SCHEMBL3678007 | 0.67 | NCF1 (0.61) | NCF1TP53CYP1A2CYP3A4USP2 | |
| SCHEMBL4744379 | 0.66 | ALDH1A1 (0.50) | KDM4EALDH1A1HPGDSMN1; SMN2KMT2A |
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-2005047259-A1 | 4-ANILINO-3-QUINOLINECARBONITRILES FOR THE TREATMENT OF CHRONIC MYELOGENOUS LEUKEMIA (CML) | WYETH (US) | 2005-05-26 | — | — | WO | disclosed |