Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 6/20 | 0.72 |
| ▸ | CA2 | P00918 | 6/20 | 0.72 |
| ▸ | CES2 | O00748 | 2/20 | 0.64 |
| ▸ | CES1 | P23141 | 2/20 | 0.64 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.59 |
| ▸ | PARP1 | P09874 | 1/20 | 0.59 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.59 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | PLK1 | P53350 | 1/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.54 |
| ▸ | GSK3B | P49841 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL247019 | 0.98 | CA1 (0.75) | CA1CA2CES2CES1PARP10 | |
| SCHEMBL19795544 | 0.90 | CA1 (0.64) | CA1CA2CES2CES1PARP10 | |
| SCHEMBL247020 | 0.90 | CES2 (0.71) | CA1CA2CES2CES1PARP10 | |
| SCHEMBL10004421 | 0.89 | CA1 (0.69) | CA1CA2CES2CES1PARP10 | |
| SCHEMBL11249046 | 0.88 | CA1 (0.62) | CA1CA2CES2CES1PARP10 | |
| SCHEMBL4998485 | 0.87 | CA1 (0.67) | CA1CA2CES2CES1PARP10 | |
| SCHEMBL28586063 | 0.85 | CA1 (0.64) | CA1CA2CES2CES1PARP10 | |
| SCHEMBL27621397 | 0.85 | CA1 (0.64) | CA1CA2CES2CES1PARP10 | |
| SCHEMBL11710716 | 0.85 | NPC1 (0.62) | CA1CA2CES2CES1PARP10 | |
| SCHEMBL11710709 | 0.85 | NPC1 (0.62) | CA1CA2CES2CES1PARP10 |
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-110156733-A | A kind of tyrosinase inhibitor and its application | 润和生物医药科技(汕头)有限公司 | 2019-08-23 | — | — | CN | disclosed |