Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 2/20 | 0.34 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 8/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18397055 | 0.79 | TDP1 (0.33) | OPRL1 | |
| SCHEMBL20582117 | 0.79 | TKT (0.39) | OPRL1KDM4EALDH1A1TKT | |
| SCHEMBL20581874 | 0.79 | ALDH1A1 (0.39) | SMN1; SMN2OPRL1CYP1A2KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL20581875 | 0.77 | ALDH1A1 (0.38) | SMN1; SMN2OPRL1CYP1A2KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL1713704 | 0.77 | TAAR1 (0.41) | TAAR1 | |
| SCHEMBL23094533 | 0.74 | PDE10A (0.34) | OPRL1 | |
| SCHEMBL12523394 | 0.74 | PDE8B (0.36) | OPRL1CYP1A2KDM4EL3MBTL1 | |
| SCHEMBL25252180 | 0.74 | OPRL1 (0.33) | OPRL1 | |
| SCHEMBL485877 | 0.74 | HDAC4 (0.35) | OPRL1TKT | |
| SCHEMBL24785081 | 0.73 | PDE10A (0.38) | OPRL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103980206-A | Pyrimidine ethylamine compound and preparation method thereof | SPHINX SCIENT LAB CORP | 2014-08-13 | — | — | CN | claimed |
| CN-103980206-B | A kind of pyrimidine ethylamine compounds and preparation method thereof | Tianjin Sphinx Medicine R&D Co., Ltd. (CN) | 2015-09-16 | — | — | CN | disclosed |
| CN-103980206-B | A kind of pyrimidine ethylamine compounds and preparation method thereof | Tianjin Sphinx Medicine R&D Co., Ltd. (CN) | 2015-09-16 | — | — | CN | disclosed |
| CN-103980206-A | Pyrimidine ethylamine compound and preparation method thereof | SPHINX SCIENT LAB CORP | 2014-08-13 | — | — | CN | disclosed |
| CN-103980206-A | Pyrimidine ethylamine compound and preparation method thereof | SPHINX SCIENT LAB CORP | 2014-08-13 | — | — | CN | disclosed |