Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK1E | P49674 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | CPA3 | P15088 | 2/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CPA1 | P15085 | 2/20 | 0.35 |
| ▸ | PAM | P19021 | 1/20 | 0.35 |
| ▸ | CPB1 | P15086 | 1/20 | 0.35 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.35 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.35 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8634822 | 0.80 | SIGMAR1 (0.47) | SIGMAR1MAOASLC6A3 | |
| SCHEMBL4469506 | 0.76 | EPHX1 (0.55) | EPHX1CPA3TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL133038 | 0.70 | SIGMAR1 (0.58) | SIGMAR1MAOA | |
| SCHEMBL130278 | 0.70 | SIGMAR1 (0.58) | SIGMAR1MAOA | |
| SCHEMBL24108632 | 0.70 | EPHX1 (0.48) | CSNK1EEPHX1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL4197623 | 0.69 | TRPA1 (0.54) | EPHX1CPA3TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL10521135 | 0.69 | TRPA1 (0.54) | EPHX1CPA3TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL132471 | 0.68 | MAOA (0.58) | SIGMAR1MAOA | |
| SCHEMBL9182651 | 0.67 | EPHX1 (0.70) | CSNK1EEPHX1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL27295809 | 0.67 | EPHX1 (0.70) | CSNK1EEPHX1TAAR1SLC6A2SIGMAR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005063304-A2 | POLY (L-GLUTAMIC ACID) PARAMAGNETIC MATERIAL COMPLEX AND USE AS A BIODEGRADABLE MRI CONTRAST AGENT | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS_SYSTEM (US) | 2005-07-14 | — | — | WO | disclosed |