Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.46 |
| ▸ | BAD | Q92934 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.40 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | RARA | P10276 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12520344 | 0.93 | CYP1A2 (0.46) | KDM4EBCL2L1BADTSHRALDH1A1 | |
| SCHEMBL29766531 | 0.91 | KDM4E (0.55) | KDM4EBCL2L1BADPTPN1TSHR | |
| SCHEMBL1285483 | 0.91 | KDM4E (0.55) | KDM4EBCL2L1BADPTPN1TSHR | |
| SCHEMBL7358277 | 0.89 | KDM4E (0.57) | KDM4EPTPN1TSHRALDH1A1HPGD | |
| SCHEMBL6415513 | 0.85 | BCL2L1 (0.52) | KDM4EBCL2L1BADPTPN1TSHR | |
| SCHEMBL14829725 | 0.83 | KDM4E (0.50) | KDM4EPTPN1TSHRALDH1A1HPGD | |
| SCHEMBL727139 | 0.80 | CES2 (0.52) | KDM4EPTPN1TSHRALDH1A1HPGD | |
| SCHEMBL29375279 | 0.80 | CES2 (0.52) | KDM4EPTPN1TSHRALDH1A1HPGD | |
| SCHEMBL6916181 | 0.78 | KDM4E (0.68) | KDM4EPTPN1TSHRALDH1A1HPGD | |
| SCHEMBL18758 | 0.78 | KDM4E (0.68) | KDM4EPTPN1TSHRALDH1A1HPGD |
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-2011061168-A1 | ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS | NOVARTIS AG (CH) | 2011-05-26 | — | — | WO | disclosed |