Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | MC3R | P41968 | 1/20 | 0.43 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL8533354 | 0.93 | KDM4E (0.52) | KDM4ENAPRTHCAR2TSHRADORA3 | |
| Acetic Acid SCHEMBL27625875 | 0.89 | KDM4E (0.48) | KDM4ENAPRTHCAR2TSHRADORA3 | |
| Maleic Acid SCHEMBL28103333 | 0.85 | KDM4E (0.45) | KDM4ENAPRTHCAR2TSHRADORA3 | |
| SCHEMBL6771 | 0.85 | — | — | |
| SCHEMBL29460909 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL29268322 | 0.83 | HSP90AA1 (0.43) | KDM4ENAPRTHCAR2TSHRADORA3 | |
| SCHEMBL28110137 | 0.83 | — | — | |
| SCHEMBL27649543 | 0.83 | — | — | |
| SCHEMBL9177452 | 0.83 | — | — | |
| Ammonia Solution, Strong SCHEMBL27297175 | 0.83 | — | — |
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-0561421-A1 | Process for the preparation of carboxylic acid chlorides of aromatic nitrogen-containing heterocycles | LONZA AG (CH) | 1993-09-22 | — | — | EP | disclosed |