Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12525535 | 0.80 | ACHE (0.38) | ALDH1A1TDP1CYP3A4POLBLMNA | |
| SCHEMBL10151669 | 0.79 | ALDH1A1 (0.37) | ALDH1A1TDP1CYP3A4ADRA2ATP53 | |
| SCHEMBL21648661 | 0.77 | KDM4E (0.38) | ALDH1A1TDP1ADRA2APOLBLMNA | |
| SCHEMBL25900783 | 0.77 | LMNA (0.46) | ALDH1A1LMNAHTTPTGS1PTGS2 | |
| SCHEMBL29325027 | 0.76 | — | — | |
| SCHEMBL21793456 | 0.75 | TDP1 (0.44) | ALDH1A1TDP1CYP3A4ADRA2ATP53 | |
| SCHEMBL3185975 | 0.75 | TDP1 (0.44) | ALDH1A1TDP1CYP3A4ADRA2ATP53 | |
| SCHEMBL7534914 | 0.74 | TSHR (0.39) | ALDH1A1CYP3A4LMNATSHRKMT2A | |
| SCHEMBL20671017 | 0.73 | ALDH1A1 (0.55) | ALDH1A1TDP1CYP3A4TP53TSHR | |
| Hydrochloric Acid SCHEMBL2868438 | 0.73 | TDP1 (0.42) | ALDH1A1TDP1CYP3A4ADRA2ATP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3892618-A1 | 4-PYRIDINYL FORMAMIDE COMPOUND OR DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF | Qingdao KingAgroot Chemical Compound Co., Ltd. (CN) | 2021-10-13 | — | — | EP | disclosed |