Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.48 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.48 |
| ▸ | EPHB3 | P54753 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PRKDC | P78527 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | AGXT | P21549 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.43 |
| ▸ | ATR | Q13535 | 1/20 | 0.42 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.42 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19381144 | 0.74 | CCR5 (0.62) | CYP3A4LRRK2SLCO1B1CNR1CNR2 | |
| SCHEMBL14259466 | 0.73 | AGXT (0.52) | CYP3A4LRRK2SLCO1B1CNR1CNR2 | |
| SCHEMBL3320288 | 0.73 | ATM (0.52) | CYP3A4LRRK2SLCO1B1CNR1CNR2 | |
| SCHEMBL4295800 | 0.72 | MAPT (0.61) | CYP3A4LRRK2SLCO1B1ALDH1A1MAPK1 | |
| SCHEMBL1735538 | 0.72 | ALDH1A1 (0.56) | CYP3A4LRRK2SLCO1B1CNR1CNR2 | |
| SCHEMBL1263059 | 0.72 | AGXT (0.61) | ALDH1A1ALOX15TSHRMAPK1HSD17B10 | |
| SCHEMBL24567287 | 0.72 | EPHB3 (0.53) | EPHB3ALDH1A1PRKDCPIK3CGMEN1 | |
| SCHEMBL24567286 | 0.72 | EPHB3 (0.53) | EPHB3ALDH1A1ALOX15TSHRPRKDC | |
| SCHEMBL33913 | 0.72 | SMPD3 (0.55) | EPHB3ALDH1A1ALOX15TSHRPRKDC | |
| SCHEMBL24567313 | 0.72 | EPHB3 (0.50) | EPHB3ALDH1A1ALOX15TSHRHSD17B10 |
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-2022140527-A1 | 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS | AJAX THERAPEUTICS, INC. (US) | 2022-06-30 | — | — | WO | disclosed |