Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT2B | Q92831 | 1/20 | 0.47 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.36 |
| ▸ | DOT1L | Q8TEK3 | 1/20 | 0.31 |
| ▸ | MAP3K12 | Q12852 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL21386122 | 1.00 | KAT2B (0.47) | KAT2BKDM2BDOT1LMAP3K12ALDH1A1 | |
| SCHEMBL28624784 | 0.89 | KAT2B (0.37) | KAT2B | |
| SCHEMBL28624781 | 0.89 | KAT2B (0.37) | KAT2B | |
| SCHEMBL12568618 | 0.82 | SIGMAR1 (0.37) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28866191 | 0.82 | ALDH1A1 (0.40) | KAT2BDOT1LALDH1A1 | |
| SCHEMBL9927923 | 0.82 | SIGMAR1 (0.37) | ALDH1A1 | |
| SCHEMBL20079175 | 0.82 | KAT2B (0.45) | KAT2BKDM2B | |
| SCHEMBL20079172 | 0.82 | KAT2B (0.45) | KAT2BKDM2B | |
| SCHEMBL9927934 | 0.81 | SIGMAR1 (0.40) | ALDH1A1 | |
| SCHEMBL12568614 | 0.81 | SIGMAR1 (0.40) | ALDH1A1 |
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-3294732-B1 | BENZIMIDAZOLE AND IMADAZOPYRIDINE CARBOXIMIDAMIDE COMPOUNDS HAVING ACTIVITY AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE | GILEAD SCIENCES INC (US) | 2019-09-25 | — | — | EP | disclosed |