Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.61 |
| ▸ | PNMT | P11086 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3774965 | 0.80 | IDO1 (0.67) | IDO1PNMTTAAR1NR4A2MAOB | |
| SCHEMBL8762708 | 0.80 | IDO1 (0.67) | IDO1PNMTTAAR1NR4A2MAOB | |
| SCHEMBL30377 | 0.76 | IDO1 (0.61) | IDO1PNMTTAAR1NR4A2MAOB | |
| SCHEMBL7322910 | 0.76 | IDO1 (0.61) | IDO1PNMTTAAR1NR4A2MAOB | |
| SCHEMBL12416647 | 0.76 | IDO1 (0.61) | IDO1PNMTTAAR1NR4A2MAOB | |
| SCHEMBL10520698 | 0.76 | IDO1 (0.61) | IDO1PNMTTAAR1NR4A2MAOB | |
| SCHEMBL514104 | 0.76 | IDO1 (0.61) | IDO1PNMTTAAR1NR4A2MAOB | |
| SCHEMBL9366433 | 0.76 | IDO1 (1.00) | IDO1PNMTTAAR1 | |
| SCHEMBL11355896 | 0.76 | IDO1 (0.61) | IDO1PNMTTAAR1NR4A2MAOB | |
| SCHEMBL7170719 | 0.74 | NR4A2 (0.71) | IDO1NR4A2MAOBMAOALMNA |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110191879-A | A kind of histone methyltransferase EZH2 inhibitor, preparation method and its medical usage | 恩瑞生物医药科技（上海）有限公司 | 2019-08-30 | — | — | CN | disclosed |
| CN-105829305-B | NRF2 regulator | 葛兰素史密斯克莱知识产权发展有限公司 | 2018-11-30 | — | — | CN | disclosed |
| CN-105793238-A | Substituted benzamides and methods of use thereof | 基因泰克公司 | 2016-07-20 | — | — | CN | disclosed |
| CN-104109154-A | C-aryl glucoside derivative, preparation method and applications thereof | SHANGHAI SUN SAIL PHARMACEUTICAL SCIENCE & TECHNOLOGY CO LTD | 2014-10-22 | — | — | CN | disclosed |
| CN-103772449-A | C-aryl glucoside derivative as well as preparation method and application thereof | SHANGHAI SUN SAIL PHARMACEUTICAL SCIENCE & TECHNOLOGY CO LTD | 2014-05-07 | — | — | CN | disclosed |
| WO-1993008166-A1 | BENZO-ISOQUINOLINE DERIVATIVES AND ANALOGS AND THEIR USE IN THERAPEUTICS | THE UPJOHN COMPANY (US) | 1993-04-29 | — | — | WO | disclosed |
| EP-0539209-A1 | Benzo-isoquinoline derivatives and analogs and their use in therapeutics | THE UPJOHN COMPANY (US) | 1993-04-28 | — | — | EP | disclosed |