Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | GRM5 | P41594 | 1/20 | 0.60 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | PKM | P14618 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | THPO | P40225 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL4712658 | 0.86 | RAB9A (0.76) | ALDH1A1RAB9ANPC1GRM5GRM4 | |
| SCHEMBL13820472 | 0.80 | RAB9A (0.62) | ALDH1A1RAB9ANPC1GRM5GRM4 | |
| SCHEMBL9000525 | 0.78 | ALDH1A1 (0.66) | ALDH1A1RAB9ANPC1GRM5GRM4 | |
| SCHEMBL5756445 | 0.78 | RAB9A (0.60) | ALDH1A1RAB9ANPC1GRM5GRM4 | |
| SCHEMBL4710302 | 0.76 | ALDH1A1 (0.58) | ALDH1A1RAB9ANPC1GRM5GRM4 | |
| Hydrochloric Acid SCHEMBL9873186 | 0.76 | ALDH1A1 (0.53) | ALDH1A1RAB9ANPC1GRM5GRM4 | |
| Hydrochloric Acid SCHEMBL7294059 | 0.76 | ALDH1A1 (0.53) | ALDH1A1RAB9ANPC1GRM5GRM4 | |
| SCHEMBL4710298 | 0.76 | ALDH1A1 (0.58) | ALDH1A1RAB9ANPC1GRM5GRM4 | |
| SCHEMBL4711050 | 0.75 | RAB9A (0.67) | ALDH1A1RAB9ANPC1GRM5GRM4 | |
| SCHEMBL9088028 | 0.75 | ALDH1A1 (0.56) | ALDH1A1RAB9ANPC1GRM5GRM4 |
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 |