Known targets — ChEMBL curated mechanism
ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CHRM1CHRM2CHRM3CHRM4ESR1ESR2GABRA1GABRB1GABRG2GBA1HRH1HTR1DHTR2AOPRD1OPRK1OPRM1SLC6A2SLC6A3TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Atrazine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 5/20 | 0.36 |
| ▸ | CA2 | P00918 | 5/20 | 0.36 |
| ▸ | CA9 | Q16790 | 5/20 | 0.36 |
| ▸ | CA12 | O43570 | 4/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Cadaverine Tartrate SCHEMBL9751938 | 0.78 | KDM4E (0.31) | TDP1LMNAL3MBTL1KDM4EMAPT | |
| Ametryne SCHEMBL8541226 | 0.72 | HTT (0.47) | GAAPKMLMNAL3MBTL1ALDH1A1 | |
| Ametryne SCHEMBL9700579 | 0.72 | HTT (0.47) | GAAPKMLMNAL3MBTL1ALDH1A1 | |
| Simazine SCHEMBL9760796 | 0.71 | LMNA (0.46) | GAATDP1PKMLMNAL3MBTL1 | |
| Atrazine SCHEMBL9876340 | 0.71 | ALDH1A1 (0.39) | GAATDP1PKMLMNAL3MBTL1 | |
| Atrazine SCHEMBL367604 | 0.70 | GAA (0.58) | GAATDP1LMNAL3MBTL1ALDH1A1 | |
| Atrazine SCHEMBL8818222 | 0.70 | GAA (0.61) | GAATDP1LMNAL3MBTL1ALDH1A1 | |
| Atrazine SCHEMBL20723465 | 0.68 | GAA (0.73) | GAATDP1LMNAL3MBTL1ALDH1A1 | |
| Atrazine SCHEMBL4306269 | 0.68 | GAA (0.73) | GAATDP1LMNAL3MBTL1ALDH1A1 | |
| Atrazine SCHEMBL1516439 | 0.68 | GAA (0.73) | GAATDP1LMNAL3MBTL1ALDH1A1 |
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-0449975-A1 | NON-TIN-BASED, LOW TOXICITY ANTI-FOULING AGENTS. | BATTELLE MEMORIAL INSTITUTE (US) | 1991-10-09 | — | — | EP | disclosed |