Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | BCHE | P06276 | 5/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CASR | P41180 | 1/20 | 0.44 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5126314 | 1.00 | TAAR1 (0.51) | TAAR1KMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL28753718 | 0.83 | ALDH1A1 (0.52) | TAAR1KMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL5126317 | 0.78 | CHRM2 (0.58) | TAAR1KMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL8880839 | 0.77 | KDM4E (0.77) | KMT2AKDM4EALDH1A1MEN1HTT | |
| SCHEMBL30245831 | 0.77 | KDM4E (0.77) | KMT2AKDM4EALDH1A1MEN1HTT | |
| SCHEMBL5117521 | 0.77 | HTR2A (0.50) | TAAR1KMT2AMEN1BCHE | |
| SCHEMBL165644 | 0.76 | BCHE (0.61) | KMT2AMEN1BCHEDNM1 | |
| SCHEMBL4214871 | 0.76 | BCHE (0.61) | KMT2AMEN1BCHEDNM1 | |
| SCHEMBL1134127 | 0.75 | CHRM2 (0.74) | TAAR1KMT2AKDM4EALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL5348922 | 0.75 | BCHE (0.60) | KMT2AMEN1BCHEDNM1 |
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 |