Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP7 | P09237 | 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 | |
|---|---|---|---|---|
| SCHEMBL7749794 | 0.76 | MME (0.39) | ADAMTS4HTTMMP1MMP2MMP3 | |
| SCHEMBL2435695 | 0.73 | ADAMTS4 (0.42) | ADAMTS4HTTMMP1MMP2MMP3 | |
| SCHEMBL5122363 | 0.69 | ITGB3 (0.40) | ADAMTS4HTTSMN1; SMN2FAAH | |
| SCHEMBL5122365 | 0.69 | ITGB3 (0.40) | ADAMTS4HTTSMN1; SMN2FAAH | |
| SCHEMBL5131032 | 0.69 | ITGB3 (0.40) | ADAMTS4HTTSMN1; SMN2FAAH | |
| SCHEMBL9067217 | 0.68 | FAAH (0.41) | SMN1; SMN2FAAHACE2 | |
| SCHEMBL10891795 | 0.68 | FAAH (0.41) | SMN1; SMN2FAAHACE2 | |
| SCHEMBL725182 | 0.68 | ADAMTS4 (0.44) | ADAMTS4HTTMMP1MMP2MMP3 | |
| SCHEMBL5148621 | 0.68 | ADAMTS4 (0.44) | ADAMTS4HTTMMP1MMP2MMP3 | |
| SCHEMBL29633569 | 0.68 | ADAMTS4 (0.44) | ADAMTS4HTTMMP1MMP2MMP3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1534693-A2 | 1, 3-DIAMINO-2-HYDROXYPROPANE PRODRUG DERIVATIVES | Elan Pharmaceuticals, Inc. (US) | 2005-06-01 | — | — | EP | claimed |
| WO-2004022523-A2 | 1, 3-DIAMINO-2-HYDROXYPROPANE PRODRUG DERIVATIVES | ELAN PHARMACEUTICALS, INC. (US) | 2004-03-18 | — | — | WO | claimed |