Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.41 |
| ▸ | KDM4A | O75164 | 2/20 | 0.41 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 3/20 | 0.40 |
| ▸ | TNKS | O95271 | 2/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6079912 | 0.73 | ESR1 (0.50) | CYP1A2KDM4EL3MBTL1KDM4AEGLN1 | |
| SCHEMBL6079956 | 0.71 | KDM4E (0.44) | CYP1A2KDM4EL3MBTL1KDM4AEGLN1 | |
| SCHEMBL6080384 | 0.71 | KDM4E (0.46) | CYP1A2KDM4EL3MBTL1KDM4AEGLN1 | |
| SCHEMBL11118380 | 0.69 | KDM4E (0.79) | CYP1A2KDM4ERAB9AKMT2AALDH1A1 | |
| SCHEMBL11118383 | 0.69 | KDM4E (0.79) | CYP1A2KDM4ERAB9AKMT2AALDH1A1 | |
| SCHEMBL6080749 | 0.69 | CYP1A2 (0.54) | CYP1A2KDM4EL3MBTL1KDM4AEGLN1 | |
| SCHEMBL3246366 | 0.68 | KDM4E (0.47) | CYP1A2KDM4EL3MBTL1KDM4AEGLN1 | |
| SCHEMBL13313361 | 0.67 | CYP1A2 (0.60) | CYP1A2KDM4EL3MBTL1KDM4AEGLN1 | |
| SCHEMBL6080440 | 0.66 | P2RX3 (0.44) | CYP1A2KDM4EPARP1ALDH1A1CYP2D6 | |
| SCHEMBL7968125 | 0.65 | ACHE (0.59) | CYP1A2KDM4EL3MBTL1KDM4AEGLN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3998808-A | INSECTICIDES, FUNGICIDES | VELSICOL CHEMICAL CORPORATION (US) | 1976-12-21 | — | — | US | disclosed |
| US-3948967-A | HERBICIDE, FUNGICIDE | VELSICOL CHEMICAL CORPORATION (US) | 1976-04-06 | — | — | US | disclosed |