Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.34 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.31 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.31 |
| ▸ | PDE6D | O43924 | 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 | |
|---|---|---|---|---|
| SCHEMBL22989247 | 0.97 | MAPK10 (0.36) | CYP11B1CYP11B2MAPK10MAPK9NR3C1 | |
| SCHEMBL22989250 | 0.95 | MAPK10 (0.38) | CYP11B1CYP11B2MAPK10MAPK9KDM4E | |
| SCHEMBL22988979 | 0.93 | MAPK10 (0.35) | CYP11B1CYP11B2MAPK10MAPK9NR3C1 | |
| SCHEMBL22989255 | 0.91 | RPA1 (0.33) | MAPK10MAPK9KDM4EMEN1ALDH1A1 | |
| SCHEMBL22988983 | 0.88 | PDE1B (0.34) | KDM4EMEN1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL22989228 | 0.88 | S1PR5 (0.32) | MAPK10MAPK9 | |
| SCHEMBL22988912 | 0.86 | KDM4E (0.36) | CYP11B1CYP11B2MAPK10MAPK9NR3C1 | |
| SCHEMBL22989256 | 0.86 | SMN1; SMN2 (0.38) | CYP11B1CYP11B2MAPK10MAPK9KDM4E | |
| SCHEMBL22989182 | 0.86 | MEN1 (0.40) | KDM4EMEN1TP53CYP1A2KMT2A | |
| SCHEMBL22989253 | 0.85 | KDM4E (0.31) | KDM4E |
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-2021029757-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2021-02-18 | — | — | WO | disclosed |