Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.31 |
| ▸ | NSD2 | O96028 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18537849 | 1.00 | MCHR1 (0.37) | MCHR1CYP1A2CYP2C19LMNACYP2D6 | |
| Hydrochloric Acid SCHEMBL20358177 | 0.98 | MCHR1 (0.37) | MCHR1CYP1A2CYP2C19LMNACYP2D6 | |
| SCHEMBL6625442 | 0.78 | ALDH1A1 (0.43) | CYP1A2CYP2C19GAAALDH1A1HPGD | |
| SCHEMBL1663440 | 0.78 | MAPKAPK2 (0.45) | CYP1A2CYP2C19LMNACYP2D6BCHE | |
| SCHEMBL1662929 | 0.77 | MAPT (0.48) | MCHR1CYP1A2CYP2C19ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL10002963 | 0.77 | ALDH1A1 (0.42) | CYP1A2CYP2C19GAAALDH1A1HPGD | |
| SCHEMBL6599912 | 0.75 | LMNA (0.37) | MCHR1CYP1A2CYP2C19LMNACYP2D6 | |
| SCHEMBL3051488 | 0.75 | ALDH1A1 (0.40) | CYP1A2CYP2C19LMNACYP2D6BCHE | |
| SCHEMBL29258828 | 0.75 | TCF4 (0.44) | MCHR1CYP1A2CYP2C19LMNACYP2D6 | |
| Hydrochloric Acid SCHEMBL10002641 | 0.74 | KMT2A (0.47) | LMNAMAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3339305-B1 | INDOLE DERIVATIVE, PREPARATION METHOD THEREOF, AND USE THEREOF IN PHARMACEUTICAL DRUG | ZHEJIANG HISUN PHARM CO LTD (CN) | 2022-05-04 | — | — | EP | disclosed |