Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 2/20 | 0.33 |
| ▸ | KDM4A | O75164 | 1/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22760797 | 0.96 | ELANE (0.37) | ELANEADORA2AADORA1KDM4ECYP1A2 | |
| SCHEMBL21546493 | 0.93 | ELANE (0.36) | ELANEADORA2AADORA1KDM4ECYP1A2 | |
| SCHEMBL22761144 | 0.92 | ELANE (0.34) | ELANEADORA2AADORA1KDM4ECYP1A2 | |
| SCHEMBL21546966 | 0.92 | CHEK1 (0.36) | ADORA2AADORA1CYP1A2TSHRMAPK1 | |
| SCHEMBL22760915 | 0.91 | CHEK1 (0.35) | ADORA2AADORA1SMN1; SMN2CHEK1PGR | |
| SCHEMBL22760886 | 0.91 | CHEK1 (0.35) | ADORA2AADORA1CHEK1PGRALDH1A3 | |
| SCHEMBL21546911 | 0.90 | ADRA2C (0.34) | ELANEADORA2AADORA1CYP1A2TSHR | |
| SCHEMBL22761143 | 0.90 | PGR (0.38) | ELANEADORA2AADORA1KDM4ECYP1A2 | |
| SCHEMBL22760699 | 0.90 | CHEK1 (0.38) | ADORA2AADORA1CYP1A2CHEK1ALDH1A1 | |
| SCHEMBL22760710 | 0.89 | ELANE (0.36) | ELANEADORA2AADORA1KDM4ECYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3478793-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-11-06 | — | — | EP | disclosed |