Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 5/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17819609 | 0.79 | HCAR2 (0.62) | HCAR2ATMSMYD3CYP2C9CYP2C19 | |
| SCHEMBL26308881 | 0.79 | HCAR2 (0.62) | HCAR2ATMSMYD3CYP2C9CYP2C19 | |
| SCHEMBL1203317 | 0.78 | HCAR2 (0.60) | HCAR2ATMSMYD3CYP2C9CYP2C19 | |
| SCHEMBL906183 | 0.76 | HCAR2 (0.58) | HCAR2ATMSMYD3CYP2C9CYP2C19 | |
| Bromide SCHEMBL17504050 | 0.76 | HCAR2 (0.58) | HCAR2ATMSMYD3CYP2C9CYP2C19 | |
| SCHEMBL1857947 | 0.74 | HCAR2 (0.55) | HCAR2ATMSMYD3CYP2C9CYP2C19 | |
| SCHEMBL185789 | 0.72 | HCAR2 (1.00) | HCAR2ATMSMYD3CYP2C9CYP2C19 | |
| SCHEMBL28807541 | 0.72 | HCAR2 (1.00) | HCAR2ATMSMYD3CYP2C9CYP2C19 | |
| SCHEMBL29586507 | 0.72 | HCAR2 (1.00) | HCAR2ATMSMYD3CYP2C9CYP2C19 | |
| SCHEMBL3102318 | 0.72 | HCAR2 (0.69) | HCAR2ATMSMYD3CYP2C9CYP2C19 |
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-2019149260-A1 | PYRIDAZINOL COMPOUND, DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF | 青岛清原化合物有限公司 | 2019-08-08 | — | — | WO | disclosed |