Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.33 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | METAP1 | P53582 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17468954 | 0.87 | L3MBTL1 (0.39) | L3MBTL1ZDHHC20GSTP1NPC1TSHR | |
| SCHEMBL18828587 | 0.80 | MGAM (0.44) | L3MBTL1TSHRMETAP1POLBCYP1A2 | |
| SCHEMBL19105440 | 0.79 | L3MBTL1 (0.35) | L3MBTL1ZDHHC20GSTP1NPC1TSHR | |
| SCHEMBL17469115 | 0.78 | NAAA (0.35) | L3MBTL1TSHRMETAP1CYP3A4 | |
| SCHEMBL10011573 | 0.77 | GSTP1 (0.39) | L3MBTL1ZDHHC20GSTP1NPC1TSHR | |
| SCHEMBL14073840 | 0.77 | MMP1 (0.39) | L3MBTL1GSTP1NPC1TSHR | |
| SCHEMBL15443538 | 0.76 | CA1 (0.34) | L3MBTL1ZDHHC20NPC1TSHRACHE | |
| Ethane SCHEMBL15443023 | 0.76 | MMP1 (0.38) | L3MBTL1GSTP1NPC1TSHR | |
| SCHEMBL10012875 | 0.76 | GSTP1 (0.38) | L3MBTL1ZDHHC20GSTP1NPC1TSHR | |
| SCHEMBL10011486 | 0.75 | GSTP1 (0.35) | L3MBTL1GSTP1NPC1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016012362-A1 | SUBSTITUTED CYANO CYCLOALKYL PENTA-2,4-DIENES, CYANO CYCLOALKYL PENT-2-EN-4-YNES, CYANO HETEROCYCLYL PENTA-2,4-DIENES AND CYANO HETEROCYCLYL PENT-2-EN-4-YNES AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-01-28 | — | — | WO | disclosed |