Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.55 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.55 |
| ▸ | CETP | P11597 | 3/20 | 0.52 |
| ▸ | QPCT | Q16769 | 1/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.49 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.49 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | AGXT | P21549 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30438881 | 0.92 | CALM1 (0.57) | CALM1CAMKK2CETPQPCTMTNR1A | |
| SCHEMBL30244899 | 0.90 | QPCT (0.52) | CALM1CAMKK2CETPQPCTMTNR1A | |
| SCHEMBL30854976 | 0.89 | QPCT (0.49) | CALM1CAMKK2CETPQPCTAOC3 | |
| SCHEMBL30245215 | 0.89 | CALM1 (0.50) | CALM1CAMKK2CETPQPCTMTNR1A | |
| SCHEMBL30245228 | 0.88 | CALM1 (0.44) | CALM1CAMKK2CETPQPCTMTNR1A | |
| SCHEMBL30245122 | 0.86 | CETP (0.47) | CALM1CAMKK2CETPQPCTMTNR1A | |
| SCHEMBL30245693 | 0.86 | QPCT (0.52) | CALM1CAMKK2CETPQPCTMTNR1A | |
| SCHEMBL30244968 | 0.86 | QPCT (0.49) | CALM1CAMKK2CETPQPCTMTNR1A | |
| SCHEMBL30245138 | 0.85 | QPCT (0.55) | CALM1CAMKK2CETPQPCTMTNR1A | |
| SCHEMBL30245310 | 0.85 | QPCT (0.53) | CALM1CAMKK2CETPQPCTMTNR1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117916237-A | Amino aryl integrin agonist compounds | 德克萨斯心脏研究所 | 2024-04-19 | — | — | CN | claimed |
| CN-117916237-A | Amino aryl integrin agonist compounds | 德克萨斯心脏研究所 | 2024-04-19 | — | — | CN | disclosed |