Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTBP2 | P56545 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL1515570 | 0.88 | CA2 (0.57) | CTBP2CA2ENPP2DRD2DRD1 | |
| Trifluoroacetic Acid SCHEMBL5660867 | 0.84 | SLC1A1 (0.47) | CES1TAAR1CYP1A2CYP2C19PARP1 | |
| Trifluoroacetic Acid SCHEMBL5892868 | 0.83 | CES1 (0.62) | CA2CES1KMT2A | |
| Trifluoroacetic Acid SCHEMBL4222769 | 0.83 | CTBP2 (0.51) | CTBP2CES1TAAR1GRM2GRM3 | |
| Trifluoroacetic Acid SCHEMBL6379095 | 0.83 | HTR3E (0.54) | CTBP2GRM2GRM3KMT2AKDM4E | |
| Trifluoroacetic Acid SCHEMBL5657671 | 0.83 | EGFR (0.46) | CES1TAAR1PARP1IDO1 | |
| SCHEMBL10431234 | 0.80 | CES1 (0.63) | CTBP2ENPP2CES1DRD2DRD1 | |
| Trifluoroacetic Acid SCHEMBL5657680 | 0.80 | CA2 (0.74) | CTBP2CA2CES1BLM | |
| Trifluoroacetic Acid SCHEMBL5658158 | 0.79 | CTBP2 (0.55) | CTBP2TAAR1GRM2GRM3CYP1A2 | |
| Resorcinol SCHEMBL11567030 | 0.78 | ALDH1A1 (0.57) | CA2CES1CYP1A2CYP3A4KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7309701-B2 | Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2007-12-18 | — | — | US | disclosed |