Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | PLK1 | P53350 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | LPL | P06858 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6353303 | 0.84 | IDO1 (0.37) | TP53CYP2A6CYP1A2NPC1RAB9A | |
| SCHEMBL79754 | 0.83 | CALM1 (0.50) | TP53KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL7785326 | 0.80 | NQO1 (0.47) | TP53CYP1A2KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL6270990 | 0.80 | SLC6A4 (0.42) | RAB9AALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL4390802 | 0.80 | APP (0.37) | CALM1 | |
| SCHEMBL8791282 | 0.80 | ESR1 (0.50) | CYP1A2KDM4ETAAR1ALDH1A1LMNA | |
| SCHEMBL1531966 | 0.80 | SIGMAR1 (0.37) | KDM4ETAAR1ALDH1A1LMNAMAPT | |
| SCHEMBL17956849 | 0.80 | CYP3A4 (0.50) | NPC1RAB9AALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL1531987 | 0.80 | IDO1 (0.37) | KDM4ETAAR1ALDH1A1LMNAMAPT | |
| SCHEMBL8939729 | 0.80 | TAAR1 (0.43) | CYP1A2RAB9ATAAR1MGLLALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114450011-A | Compositions and methods for treating metabolic disorders | 阿沃林特有限公司 | 2022-05-06 | — | — | CN | disclosed |
| CN-1177857-C | Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the prepararation of the derivatives | ����ҩƷ��ҵ��ʽ���� | 2004-12-01 | — | — | CN | disclosed |
| CN-1418219-A | Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the prepararation of the derivatives | KISSEI PHARMACEUTICAL (JP) | 2003-05-14 | — | — | CN | disclosed |