Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.48 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 3/20 | 0.48 |
| ▸ | CES1 | P23141 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | DAO | P14920 | 1/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27589809 | 1.00 | MTNR1A (0.48) | MTNR1AMTNR1BCES2CES1MEN1 | |
| SCHEMBL28385832 | 1.00 | MTNR1A (0.48) | MTNR1AMTNR1BCES2CES1MEN1 | |
| SCHEMBL27498418 | 1.00 | MTNR1A (0.48) | MTNR1AMTNR1BCES2CES1MEN1 | |
| SCHEMBL4863098 | 0.98 | CES2 (0.50) | MTNR1AMTNR1BCES2CES1MEN1 | |
| SCHEMBL27573431 | 0.95 | MTNR1A (0.48) | MTNR1AMTNR1BCES2CES1MEN1 | |
| Chloroform SCHEMBL5461181 | 0.94 | MTNR1A (0.44) | MTNR1AMTNR1BCES2CES1MEN1 | |
| SCHEMBL27962243 | 0.86 | TDP1 (0.44) | MTNR1AMTNR1BCES2CES1MEN1 | |
| SCHEMBL25252302 | 0.82 | NR4A1 (0.58) | CES2CES1ALDH1A1TSHRCYP2C19 | |
| Tromethamine SCHEMBL21616749 | 0.82 | MTNR1A (0.42) | MTNR1AMTNR1BCES2CES1MEN1 | |
| Tromethamine SCHEMBL5461179 | 0.80 | MTNR1A (0.39) | MTNR1AMTNR1BCES2CES1MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115052873-A | Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors | 勃林格殷格翰国际有限公司 | 2022-09-13 | — | — | CN | disclosed |
| CN-111362975-B | Naphthyridine compounds as JAK kinase inhibitors | 施万生物制药研发IP有限责任公司 | 2022-04-05 | — | — | CN | disclosed |
| CN-103502228-A | Novel photoactive polymers | MERCK PATENT GMBH | 2014-01-08 | — | — | CN | disclosed |
| CN-103140479-A | Process for producing pyrimidine derivative | NOVARTIS AG | 2013-06-05 | — | — | CN | disclosed |