Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.50 |
| ▸ | GSK3B | P49841 | 2/20 | 0.50 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | LDHA | P00338 | 1/20 | 0.46 |
| ▸ | LDHB | P07195 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 2/20 | 0.44 |
| ▸ | NOS1 | P29475 | 2/20 | 0.44 |
| ▸ | NOS2 | P35228 | 2/20 | 0.44 |
| ▸ | ESRRB | O95718 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19660005 | 0.86 | PTPN1 (0.56) | PTPN1GSK3BPDPK1ALDH1A1MAPT | |
| SCHEMBL11167372 | 0.83 | PDPK1 (0.60) | PTPN1GSK3BPDPK1ALDH1A1MAPT | |
| SCHEMBL18860300 | 0.80 | PTPN1 (0.59) | PTPN1GSK3BPDPK1ALDH1A1MAPT | |
| SCHEMBL19660211 | 0.80 | KMT2A (0.47) | ALDH1A1MAPTKMT2AL3MBTL1ESRRB | |
| SCHEMBL11262738 | 0.80 | KMT2A (0.50) | ALDH1A1MAPTKMT2AL3MBTL1ESRRB | |
| SCHEMBL6509897 | 0.79 | KMT2A (0.72) | ALDH1A1MAPTKMT2AL3MBTL1CES1 | |
| SCHEMBL16578246 | 0.78 | NOS3 (0.51) | ALDH1A1NOS3NOS1NOS2MMP2 | |
| SCHEMBL23797050 | 0.78 | ALOX15 (0.50) | ALDH1A1KMT2AL3MBTL1HDAC1HDAC8 | |
| SCHEMBL7847608 | 0.78 | PTPN1 (0.60) | PTPN1GSK3BALDH1A1MAPTMMP1 | |
| SCHEMBL658474 | 0.76 | PDPK1 (0.56) | PTPN1GSK3BPDPK1ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3464248-B1 | 3-OXO-2,6-DIPHENYL-2,3-DIHYDROPYRIDAZINE-4-CARBOXAMIDES | Bayer Pharma AG (DE) | 2021-09-08 | — | — | EP | disclosed |
| WO-2017202816-A1 | 3-OXO-2,6-DIPHENYL-2,3-DIHYDROPYRIDAZINE-4-CARBOXAMIDES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2017-11-30 | — | — | WO | disclosed |