Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | SCN1A | P35498 | 2/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA3 | P07451 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2725750 | 0.92 | — | — | |
| SCHEMBL30843947 | 0.84 | CA12 (0.56) | PAOXCYP1A2CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL360351 | 0.81 | — | — | |
| SCHEMBL29229351 | 0.81 | GRIA1 (0.42) | ALDH1A1KDM4ECA12CA1CA2 | |
| SCHEMBL28376305 | 0.79 | — | — | |
| SCHEMBL31657041 | 0.78 | PAOX (0.54) | PAOXMAOAMAOBAPPTSHR | |
| Diaminooctane SCHEMBL31657017 | 0.78 | PAOX (0.54) | PAOXMAOAMAOBAPPTSHR | |
| SCHEMBL31656963 | 0.78 | PAOX (0.54) | PAOXMAOAMAOBAPPTSHR | |
| Diaminooctane SCHEMBL31656980 | 0.78 | PAOX (0.54) | PAOXMAOAMAOBAPPTSHR | |
| SCHEMBL31657039 | 0.78 | PAOX (0.54) | PAOXMAOAMAOBAPPTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20180042899-A1 | Method of Treating Transplant Rejection and Autoimmune Diseases | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2018-02-15 | — | — | US | disclosed |
| CN-104771747-A | Western medicine/traditional Chinese medicine composition for piglets and preparation method thereof | CHENGDU QIANKUN VETERINARY PHARMACEUTICAL CO LTD | 2015-07-15 | — | — | CN | disclosed |
| US-20140050694-A1 | Method of Treating Transplant Rejection and Autoimmune Diseases | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2014-02-20 | — | — | US | disclosed |