Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 9/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.48 |
| ▸ | ACACA | Q13085 | 1/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10796756 | 0.85 | AKR1C3 (0.56) | ACACBAKR1C3AKR1C2ACACANQO1 | |
| Hydrochloric Acid SCHEMBL10915574 | 0.83 | AKR1C3 (0.55) | ACACBAKR1C3AKR1C2ACACANQO1 | |
| SCHEMBL5095769 | 0.83 | AKR1C3 (0.54) | ACACBAKR1C3AKR1C2ACACANQO1 | |
| SCHEMBL10920745 | 0.83 | ALDH1A1 (0.52) | ACACBAKR1C3AKR1C2ACACALMNA | |
| SCHEMBL11016767 | 0.82 | ACACB (0.52) | ACACBAKR1C3AKR1C2ACACAPARP10 | |
| SCHEMBL10822109 | 0.82 | PARP10 (0.49) | ACACBAKR1C3AKR1C2ACACANQO1 | |
| SCHEMBL10923719 | 0.81 | AKR1C3 (0.54) | ACACBAKR1C3AKR1C2LMNANPSR1 | |
| SCHEMBL10922377 | 0.77 | L3MBTL1 (0.46) | AKR1C3AKR1C2HPGDLMNAALDH1A1 | |
| SCHEMBL10798206 | 0.77 | NPC1 (0.44) | HPGDLMNAALDH1A1TSHR | |
| SCHEMBL10793193 | 0.77 | PTGS2 (0.47) | ACACBAKR1C3AKR1C2LMNANPSR1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4668815-A | FROM ACYL HALIDE AND ALCOHOL WITH TIRPLE BOND | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1987-05-26 | — | — | US | disclosed |
| US-4596880-A | Pesticides | BAYER AKTIENGESELLSCHAFT (DE) | 1986-06-24 | — | — | US | disclosed |
| US-4438275-A | 2,2-DIFLUORO-BENZODIOXOLES | BAYER AKTIENGESELLSCHAFT (DE) | 1984-03-20 | — | — | US | disclosed |
| US-4310540-A | PYRETHROID-LIKE COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1982-01-12 | — | — | US | disclosed |
| US-4261920-A | INSECTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1981-04-14 | — | — | US | disclosed |
| US-4242357-A | INSECTICIDES, MITICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1980-12-30 | — | — | US | disclosed |
| US-4218469-A | Combating arthropods with 3-phenoxy-fluoro-benzyl carboxylic acid esters | BAYER AKTIENGESELLSCHAFT (DE) | 1980-08-19 | — | — | US | disclosed |