Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 6/20 | 0.54 |
| ▸ | HRH1 | P35367 | 6/20 | 0.54 |
| ▸ | KIT | P10721 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL1692682 | 0.87 | HRH2 (0.48) | HRH2HRH1KITALDH1A1HTT | |
| SCHEMBL10089203 | 0.86 | HRH2 (0.47) | HRH2HRH1KITALDH1A1HTT | |
| SCHEMBL3958428 | 0.85 | HRH2 (0.47) | HRH2HRH1KITALDH1A1HTT | |
| SCHEMBL3632495 | 0.85 | HRH2 (0.47) | HRH2HRH1KITALDH1A1HTT | |
| SCHEMBL18482713 | 0.85 | HRH2 (0.47) | HRH2HRH1KITALDH1A1HTT | |
| SCHEMBL9051052 | 0.84 | ALDH1A1 (0.56) | HRH2HRH1ALDH1A1HTTKMT2A | |
| SCHEMBL24664442 | 0.84 | HRH2 (0.49) | HRH2HRH1KITALDH1A1HTT | |
| SCHEMBL18482715 | 0.83 | HRH2 (0.46) | HRH2HRH1KITALDH1A1HTT | |
| Hydrochloric Acid SCHEMBL27445572 | 0.82 | ALDH1A1 (0.58) | HRH2HRH1ALDH1A1HTTKMT2A | |
| SCHEMBL8921640 | 0.82 | RAB9A (0.45) | HRH2HRH1KITALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-RE44205-E1 | Adenosine A2a receptor antagonists | MERCK SHARP & DOHME CORP. (US) | 2013-05-07 | — | — | US | disclosed |