Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 4/20 | 0.33 |
| ▸ | HTR2B | P41595 | 4/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14335281 | 0.76 | HTR2C (0.46) | HTR2CHTR2BSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2896725 | 0.75 | — | — | |
| SCHEMBL14060967 | 0.73 | MGLL (0.39) | MEN1KMT2A | |
| SCHEMBL10762466 | 0.73 | NOS3 (0.41) | HTR2CHTR2BSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3867705 | 0.71 | GAA (0.36) | — | |
| SCHEMBL1161615 | 0.68 | NOS3 (0.39) | HTR2CHTR2BHTR2A | |
| SCHEMBL1583081 | 0.68 | NOS3 (0.39) | HTR2CHTR2BHTR2A | |
| SCHEMBL11099148 | 0.68 | PIK3CD (0.36) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL749347 | 0.67 | HTR2C (0.36) | HTR2CHTR2BHTR2A | |
| Hydrochloric Acid SCHEMBL1583544 | 0.67 | NOS3 (0.38) | HTR2CHTR2BSLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6750344-B1 | MONOCYCLIC AMINE SCAFFOLD BEARING AT LEAST TWO SITES OF DIVERSITY, CYCLIZED TO FORM BICYCLIC AMINE SCAFFOLDS; 7-AMINO-PYRROLO(1,2-A)PYRAZIN-4-ONE COMPOUNDS | ISIS PHARMACEUTICALS, INC. | 2004-06-15 | — | — | US | disclosed |
| US-6316626-B1 | Amine compounds and combinatorial libraries comprising same | ISIS PHARMACEUTICALS, INC. | 2001-11-13 | — | — | US | disclosed |