Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | F12 | P00748 | 1/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29373118 | 0.96 | ACHE (0.49) | CYP3A4LMNAMAPTAPEX1MAPK1 | |
| SCHEMBL232662 | 0.96 | ACHE (0.49) | CYP3A4LMNAMAPTAPEX1MAPK1 | |
| Hydrochloric Acid SCHEMBL7823346 | 0.95 | ACHE (0.48) | CYP3A4LMNAMAPTAPEX1MAPK1 | |
| SCHEMBL30542089 | 0.95 | ACHE (0.48) | CYP3A4LMNAMAPTAPEX1MAPK1 | |
| Bromide SCHEMBL5146705 | 0.95 | ACHE (0.48) | CYP3A4LMNAMAPTAPEX1MAPK1 | |
| Bromide SCHEMBL28325156 | 0.95 | ACHE (0.48) | CYP3A4LMNAMAPTAPEX1MAPK1 | |
| SCHEMBL1446013 | 0.90 | ACHE (0.48) | CYP3A4LMNAMAPK1ACHECYP2A6 | |
| Pyrrole SCHEMBL29161105 | 0.88 | ACHE (0.44) | CYP3A4MAPTACHECYP2A6F12 | |
| SCHEMBL1445784 | 0.87 | ACHE (0.49) | ACHECYP2A6F12PLAUNCF1 | |
| SCHEMBL12403531 | 0.86 | RAB9A (0.43) | CYP3A4LMNAMAPTMAPK1PMP22 |
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-1113869-C | Two aporphine-benzyl isoquinoline compounds with antineoplastic activity | XIAO PEIGEN (CN) | 2003-07-09 | — | — | CN | claimed |
| CN-1267670-A | Two aporphine-benzyl isoquinoline compounds with antineoplastic activity | XIAO PEIGEN (CN) | 2000-09-27 | — | — | CN | claimed |
| CN-107821064-A | A kind of artificial cultivation method of SHUIHUANGLIAN | 石阡县龙腾农牧农民专业合作社 | 2018-03-23 | — | — | CN | disclosed |
| CN-101407520-B | Use of aporphine alkaloid and derivative in preparing anti-figus medicine | KUNMING GENERAL HOSPITAL CHENGDU MILITARY AREA | 2011-02-16 | — | — | CN | disclosed |
| CN-101407520-A | Novel medical uses of aporphine alkaloid and derivative thereof | KUNMING GENERAL HOSPITAL CHENG (CN) | 2009-04-15 | — | — | CN | disclosed |
| CN-1113869-C | Two aporphine-benzyl isoquinoline compounds with antineoplastic activity | XIAO PEIGEN (CN) | 2003-07-09 | — | — | CN | disclosed |
| CN-1267670-A | Two aporphine-benzyl isoquinoline compounds with antineoplastic activity | XIAO PEIGEN (CN) | 2000-09-27 | — | — | CN | disclosed |