Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 3/20 | 0.33 |
| ▸ | MGLL | Q99685 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 4/20 | 0.32 |
| ▸ | CA1 | P00915 | 4/20 | 0.32 |
| ▸ | CA2 | P00918 | 4/20 | 0.32 |
| ▸ | CA9 | Q16790 | 4/20 | 0.32 |
| ▸ | EHMT2 | Q96KQ7 | 3/20 | 0.32 |
| ▸ | EHMT1 | Q9H9B1 | 3/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | GSDMD | P57764 | 2/20 | 0.32 |
| ▸ | CA4 | P22748 | 2/20 | 0.32 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.31 |
| ▸ | GMNN | O75496 | 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 | |
|---|---|---|---|---|
| SCHEMBL27347286 | 0.92 | CA12 (0.37) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 | |
| SCHEMBL5972451 | 0.92 | CA12 (0.37) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 | |
| SCHEMBL27590106 | 0.92 | CA12 (0.37) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 | |
| SCHEMBL27609015 | 0.92 | CA12 (0.37) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 | |
| Ammonia Solution, Strong SCHEMBL27539814 | 0.90 | CA12 (0.36) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 | |
| Ethane SCHEMBL27645957 | 0.90 | CA12 (0.36) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 | |
| Hydrochloric Acid SCHEMBL28165273 | 0.90 | CA12 (0.36) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 | |
| Bromide SCHEMBL28081839 | 0.90 | CA12 (0.36) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 | |
| Propane SCHEMBL28132313 | 0.90 | CA12 (0.36) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 | |
| SCHEMBL28243773 | 0.88 | CA12 (0.34) | PHGDHMGLLL3MBTL1ALDH1A1CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108430997-A | Kill microorganism oxadiazole derivatives | 先正达参股股份有限公司 | 2018-08-21 | — | — | CN | disclosed |
| CN-107667090-A | PESTICIDALLY ACTIVE OXIME AND HYDRAZONE DERIVATIVES | 先正达参股股份有限公司 | 2018-02-06 | — | — | CN | disclosed |
| CN-107428699-A | Pesticidally active carbamylated and thiocarbamoylated oxime derivatives | 先正达参股股份有限公司 | 2017-12-01 | — | — | CN | disclosed |
| CN-107207450-A | Kill the active semicarbazones of harmful organism and thiosemicarbazone derivative | 先正达参股股份有限公司 | 2017-09-26 | — | — | CN | disclosed |