Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 7/20 | 0.42 |
| ▸ | MGMT | P16455 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.35 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13654238 | 0.86 | NAAA (0.58) | NAAAABCG2MGMT | |
| SCHEMBL16437095 | 0.86 | NAAA (0.58) | NAAAABCG2MGMT | |
| SCHEMBL13671102 | 0.86 | NAAA (0.58) | NAAAABCG2MGMT | |
| SCHEMBL13671096 | 0.86 | NAAA (0.58) | NAAAABCG2MGMT | |
| SCHEMBL13671097 | 0.86 | NAAA (0.58) | NAAAABCG2MGMT | |
| SCHEMBL16898560 | 0.84 | TAAR1 (0.38) | ABCG2MGMTIDO1 | |
| SCHEMBL17414391 | 0.81 | NAAA (0.53) | NAAAABCG2IDO1 | |
| SCHEMBL17162030 | 0.81 | NAAA (0.54) | NAAAABCG2MGMT | |
| SCHEMBL25272282 | 0.79 | ABCG2 (0.39) | NAAAABCG2MGMT | |
| SCHEMBL25270748 | 0.79 | DRD4 (0.49) | MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-116322777-A | Heteroaryl and heterocyclyl compounds | 西吉隆医疗股份有限公司 | 2023-06-23 | — | — | CN | disclosed |