Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 4/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | CCNC | P24863 | 1/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 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 | |
|---|---|---|---|---|
| SCHEMBL6861398 | 0.83 | TLR8 (0.50) | PKMCYP19A1ADORA2ATLR8DHODH | |
| SCHEMBL28710551 | 0.79 | NOTUM (0.50) | BRD4GAAPKMTSHRCYP19A1 | |
| SCHEMBL28706154 | 0.78 | NPSR1 (0.42) | BRD4GAAPKMTSHRCYP19A1 | |
| SCHEMBL28027825 | 0.77 | BRD4 (0.64) | BRD4GAACYP19A1ADORA2ATLR8 | |
| SCHEMBL2337948 | 0.77 | BRD4 (0.48) | BRD4CYP19A1ADORA2ATLR8NOTUM | |
| SCHEMBL15135930 | 0.76 | TUBB4A (0.48) | — | |
| SCHEMBL2337941 | 0.76 | PDE10A (0.47) | BRD4TSHRCYP19A1ADORA2ALMNA | |
| SCHEMBL28426192 | 0.76 | TLR8 (0.60) | BRD4PKMCYP19A1ADORA2ATLR8 | |
| SCHEMBL28717264 | 0.76 | BRD4 (0.49) | BRD4GAACYP19A1ADORA2ATLR8 | |
| SCHEMBL1927995 | 0.73 | PDE10A (0.47) | BRD4GAAPKMCYP19A1ADORA2A |
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-114230522-A | Imidazole-2-carboxylic acid metal beta-lactamase inhibitor and preparation method and application thereof | 四川大学 | 2022-03-25 | — | — | CN | disclosed |