Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | PTK2B | Q14289 | 2/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.41 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | CHKA | P35790 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14922258 | 0.84 | ADRB1 (0.53) | SIRT6HTR3A | |
| SCHEMBL8363117 | 0.75 | KMT2A (0.66) | HRH3KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL9322641 | 0.73 | LTA4H (0.43) | KMT2AMEN1ESR2 | |
| SCHEMBL13897218 | 0.73 | HTR1A (0.41) | ALDH1A1TAAR1RECQL | |
| SCHEMBL22022308 | 0.72 | HRH3 (0.61) | HRH3KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL14922325 | 0.72 | MEN1 (0.55) | HRH3KMT2AMEN1MAPTGAA | |
| SCHEMBL3035705 | 0.71 | DRD2 (0.47) | KMT2AMEN1MAPTDRD2L3MBTL1 | |
| SCHEMBL3035707 | 0.71 | DRD2 (0.47) | KMT2AMEN1MAPTDRD2L3MBTL1 | |
| SCHEMBL14922320 | 0.71 | HRH3 (0.52) | HRH3KMT2AMEN1MAPTALDH1A1 | |
| SCHEMBL21659428 | 0.71 | HRH3 (0.68) | HRH3KMT2AMEN1MAPTALDH1A1 |
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-RE44205-E1 | Adenosine A2a receptor antagonists | MERCK SHARP & DOHME CORP. (US) | 2013-05-07 | — | — | US | disclosed |
| US-RE44205-E1 | Adenosine A2a receptor antagonists | MERCK SHARP & DOHME CORP. (US) | 2013-05-07 | — | — | US | disclosed |