Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28887973 | 0.86 | CYP3A4 (0.40) | CYP1A2CYP1B1ALDH1A1HPGDMAPT | |
| SCHEMBL28959066 | 0.81 | ABCG2 (0.48) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL8763513 | 0.72 | RET (0.51) | RETCYP1A2CYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL28959074 | 0.70 | KDM4E (0.41) | CYP1A2CYP1A1CYP1B1ALDH1A1HPGD | |
| SCHEMBL26828212 | 0.69 | RET (0.47) | RETCYP1A2ALDH1A1HPGDMAPT | |
| SCHEMBL28887688 | 0.69 | KDM4E (0.42) | CYP1A2ALDH1A1HPGDMAPTKDM4E | |
| SCHEMBL29839905 | 0.67 | MCL1 (0.54) | ALDH1A1HPGDMAPTKDM4ETDP1 | |
| SCHEMBL28887681 | 0.66 | ALDH1A1 (0.32) | CYP1A2ALDH1A1HPGDKDM4ETSHR | |
| SCHEMBL29839875 | 0.65 | LMNA (0.61) | RETCYP1A2CYP1B1ALDH1A1HPGD | |
| SCHEMBL17616678 | 0.65 | ALDH1A1 (0.46) | CYP1A2CYP1B1ALDH1A1HPGDMAPT |
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-110372660-B | Synthetic method of isocoumarin derivatives | 天津大学 | 2022-11-22 | — | — | CN | disclosed |