Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.56 |
| ▸ | TYK2 | P29597 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.50 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | PLOD1 | Q02809 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL126697 | 0.87 | ALDH1A1 (0.59) | ALDH1A1KMT2APOLBMAPTHPGD | |
| SCHEMBL29251267 | 0.80 | KMT2A (0.52) | ALDH1A1CYP3A4KMT2APOLBMAPT | |
| SCHEMBL27800573 | 0.79 | NPC1 (0.56) | ALDH1A1KMT2APOLBMAPTKCNK3 | |
| SCHEMBL27750735 | 0.76 | KMT2A (0.52) | JAK2TYK2ALDH1A1KMT2APOLB | |
| SCHEMBL27576014 | 0.76 | TAAR1 (0.66) | JAK2TYK2HTTALDH1A1EPHX1 | |
| SCHEMBL28887476 | 0.76 | KMT2A (0.47) | ALDH1A1KMT2APOLBMAPTKDM4E | |
| Benzoic Acid Hydrazide SCHEMBL28704484 | 0.76 | CYP1A2 (0.84) | JAK2TYK2HTTALDH1A1CYP3A4 | |
| SCHEMBL2986200 | 0.75 | ALDH1A1 (0.83) | JAK2TYK2HTTALDH1A1CYP3A4 | |
| SCHEMBL8893985 | 0.74 | MAPK13 (0.55) | ALDH1A1KMT2APOLBMAPTHPGD | |
| SCHEMBL6555987 | 0.74 | NPSR1 (0.51) | ALDH1A1KMT2APOLBMAPTKCNK3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1839126-A | Novel cyanopyridine derivatives for the treatment of cancer and other disorders | BAYER PHARMACEUTICALS CORP (US) | 2006-09-27 | — | — | CN | claimed |
| CN-1839126-A | Novel cyanopyridine derivatives for the treatment of cancer and other disorders | BAYER PHARMACEUTICALS CORP (US) | 2006-09-27 | — | — | CN | disclosed |