Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | CCL2 | P13500 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9198898 | 0.93 | GRIN1 (0.34) | HTR2AGRIN1GRIN2AGRIN2B | |
| SCHEMBL28824445 | 0.67 | BRD4 (0.40) | HTR2ABRD4CCL2 | |
| SCHEMBL27951331 | 0.60 | BRD4 (0.37) | HTR2ASMN1; SMN2BRD4CCL2 | |
| SCHEMBL11155913 | 0.58 | BRD4 (0.49) | HTR2ASMN1; SMN2BRD4CCL2 | |
| Ethylenediamine SCHEMBL8371784 | 0.57 | CA12 (0.53) | SMN1; SMN2 | |
| SCHEMBL16078964 | 0.57 | ACE2 (0.63) | — | |
| Diethanolamine SCHEMBL1043915 | 0.57 | SMN1; SMN2 (0.50) | SMN1; SMN2 | |
| SCHEMBL10694747 | 0.56 | BRD4 (0.55) | HTR2ASMN1; SMN2BRD4CCL2 | |
| SCHEMBL7570833 | 0.56 | BRD4 (0.42) | HTR2ASMN1; SMN2BRD4CCL2 | |
| SCHEMBL10688105 | 0.56 | BRD4 (0.46) | HTR2ASMN1; SMN2BRD4CCL2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0662076-A1 | 2-AMINOALKYL-5-AMINOALKYLAMINO SUBSTITUTED ISOQUINOINDAZOLE-6-(2H)-ONES WITH ANTITUMOUR ACTIVITY | THE UNIVERSITY OF VERMONT (US) | 1995-07-12 | — | — | EP | claimed |