Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8541571 | 0.82 | USP2 (0.44) | ALDH1A1KDM4EUSP2ALOX15 | |
| SCHEMBL8564491 | 0.81 | SLC6A9 (0.38) | ALDH1A1KDM4EPOLBSMN1; SMN2SLC6A9 | |
| SCHEMBL8562841 | 0.75 | HSD11B1 (0.40) | ALDH1A1KDM4EPOLBHSD17B10TDP1 | |
| SCHEMBL20280994 | 0.75 | ALDH1A1 (0.47) | ALDH1A1KDM4EPOLBSMN1; SMN2USP2 | |
| SCHEMBL8314707 | 0.75 | ALDH1A1 (0.39) | ALDH1A1KDM4EPOLBSMN1; SMN2SLC6A9 | |
| SCHEMBL8313856 | 0.74 | ALDH1A1 (0.39) | ALDH1A1KDM4EPOLBSMN1; SMN2SLC6A9 | |
| SCHEMBL8673338 | 0.74 | SLC6A9 (0.43) | ALDH1A1KDM4EPOLBSMN1; SMN2SLC6A9 | |
| SCHEMBL20281069 | 0.73 | ALDH1A1 (0.46) | ALDH1A1KDM4EPOLBSMN1; SMN2USP2 | |
| SCHEMBL8478396 | 0.73 | ALDH1A1 (0.33) | ALDH1A1KDM4EPOLB | |
| SCHEMBL8559427 | 0.72 | ALDH1A1 (0.49) | ALDH1A1KDM4EPOLBUSP2ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| US-5871709-A | TETRAAZACYCLODODECANE COMPOUNDS SUBSTITUTED WITH ALKYL CARBOXY COMPOUNDS FOR CARDIOVASCULAR DISORDERS AND BRAIN TUMORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-02-16 | — | — | US | disclosed |