Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.43 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.42 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24963554 | 0.80 | KMT2A (0.51) | ALDH1A1LPAR1CA12CA1CA2 | |
| SCHEMBL1440034 | 0.79 | ALDH1A1 (0.53) | ALDH1A1LPAR1KCNK3KCNK9CA12 | |
| SCHEMBL18415530 | 0.75 | CA12 (0.52) | ALDH1A1LPAR1KCNK3KCNK9CA12 | |
| SCHEMBL10817822 | 0.75 | CXCL8 (0.48) | ALDH1A1KDM4ELMNACYP1A2KMT2A | |
| SCHEMBL2095565 | 0.73 | CA12 (0.50) | ALDH1A1LPAR1KCNK3KCNK9CA12 | |
| SCHEMBL7500143 | 0.73 | KDM4E (0.53) | ALDH1A1KCNK3KCNK9CA12CA1 | |
| SCHEMBL2095568 | 0.73 | CA12 (0.55) | ALDH1A1LPAR1KCNK3KCNK9CA12 | |
| SCHEMBL10813852 | 0.72 | HTT (0.58) | ALDH1A1RAB9ASMN1; SMN2L3MBTL1CYP1A2 | |
| SCHEMBL9021594 | 0.72 | CA12 (0.46) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL7500132 | 0.72 | CA12 (0.48) | ALDH1A1LPAR1KCNK3KCNK9CA12 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4698333-A | Use of substituted malonic acid derivatives as agents for combating pests | BAYER AKTIENGESELLSCHAFT (DE) | 1987-10-06 | — | — | US | disclosed |
| EP-0076957-B1 | DIAMIDES OF SUBSTITUTED HYDROXYMALONIC ACIDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES | BAYER AG (DE) | 1986-04-09 | — | — | EP | disclosed |
| US-4562185-A | INSECTICIDES; MITICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1985-12-31 | — | — | US | disclosed |
| US-4556649-A | Substituted malonic acid diamide insecticides, compositions and use | BAYER AKTIENGESELLSCHAFT (DE) | 1985-12-03 | — | — | US | disclosed |
| EP-0148499-A2 | Substituted derivatives of malonic acid, process for their preparation and their use as pesticides | BAYER AG (DE) | 1985-07-17 | — | — | EP | disclosed |
| EP-0126235-A1 | Five-membered nitrogen-containing heterocycles, process for their preparation and their use as pesticides | BAYER AG (DE) | 1984-11-28 | — | — | EP | disclosed |
| EP-0108351-A2 | Use of substituted malonic-acid derivatives as pesticides | BAYER AG (DE) | 1984-05-16 | — | — | EP | disclosed |
| EP-0076957-A1 | Diamides of substituted hydroxymalonic acids, process for their preparation and their use as pesticides | BAYER AG (DE) | 1983-04-20 | — | — | EP | disclosed |