Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13326025 | 0.83 | ADORA2A (0.48) | ADORA2AADORA1 | |
| SCHEMBL23254754 | 0.81 | SMN1; SMN2 (0.50) | NAMPTSMN1; SMN2 | |
| SCHEMBL15259131 | 0.80 | NAMPT (0.52) | NAMPTSMN1; SMN2 | |
| SCHEMBL23254969 | 0.80 | SMN1; SMN2 (0.48) | NAMPTSMN1; SMN2 | |
| SCHEMBL6695129 | 0.79 | KDM4E (0.49) | SMN1; SMN2 | |
| SCHEMBL6674215 | 0.79 | SMN1; SMN2 (0.50) | NAMPTSMN1; SMN2 | |
| SCHEMBL17564596 | 0.78 | GAA (0.51) | ADORA2AADORA1BRD4 | |
| SCHEMBL8545612 | 0.78 | NAMPT (0.52) | NAMPTSMN1; SMN2 | |
| SCHEMBL13326022 | 0.78 | ADORA2A (0.47) | ADORA2AADORA1BRD4 | |
| SCHEMBL8590843 | 0.78 | SMN1; SMN2 (0.50) | NAMPTSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7749940-B2 | Facilitated forward chemical genetics using tagged triazine library | NEW YORK UNIVERSITY (US) | 2010-07-06 | — | — | US | disclosed |
| US-20050019831-A1 | Facilitated forward chemical genetics using tagged triazine library | NEW YORK UNIVERSITY (US) | 2005-01-27 | — | — | US | disclosed |
| WO-2004099106-A2 | FACILITATED FORWARD CHEMICAL GENETICS USING TAGGED TRIAZINE LIBRARY | NEW YORK UNIVERSITY (US) | 2004-11-18 | — | — | WO | disclosed |