Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 8/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | PDE4A | P27815 | 1/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.55 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.55 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.55 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL11382208 | 0.89 | SMN1; SMN2 (0.62) | ADORA2BSMN1; SMN2RXFP1LMNAMAPK1 | |
| SCHEMBL6743410 | 0.88 | ADORA2B (0.66) | ADORA2BSMN1; SMN2RXFP1LMNAMAPK1 | |
| SCHEMBL17626126 | 0.85 | ADORA2B (0.65) | ADORA2BSMN1; SMN2RXFP1LMNAMAPK1 | |
| SCHEMBL28025751 | 0.85 | ADORA2B (1.00) | ADORA2BSMN1; SMN2RXFP1LMNAMAPK1 | |
| SCHEMBL11321532 | 0.83 | TNF (0.66) | ADORA2BSMN1; SMN2RXFP1LMNAMAPK1 | |
| SCHEMBL15396540 | 0.82 | SMN1; SMN2 (0.70) | ADORA2BSMN1; SMN2RXFP1LMNAMAPK1 | |
| SCHEMBL11380345 | 0.82 | MAPK1 (0.61) | ADORA2BSMN1; SMN2RXFP1LMNAMAPK1 | |
| SCHEMBL11385104 | 0.81 | MAPK1 (0.60) | ADORA2BSMN1; SMN2RXFP1LMNAMAPK1 | |
| SCHEMBL11379715 | 0.81 | MAPK1 (0.60) | ADORA2BSMN1; SMN2RXFP1LMNAMAPK1 | |
| SCHEMBL8443037 | 0.80 | ADORA2B (0.77) | ADORA2BSMN1; SMN2LMNAMAPTPDE4A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102796102-B | Caffeine haptens, conjugate and application, caffeine detection or measuring method | GUANGZHOU WANDFO BIOTECHNOLOGY CO.,LTD. (CN) | 2015-09-16 | — | — | CN | disclosed |
| CN-102796102-A | Caffeine hapten, conjugate, applications of caffeine hapten and conjugate, and method for detecting or determining caffeine | GUANGZHOU WANDOFO BIOMEDICAL CO LTD | 2012-11-28 | — | — | CN | disclosed |