Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | TNF | P01375 | 1/20 | 0.34 |
| ▸ | LTB4R | Q15722 | 3/20 | 0.34 |
| ▸ | LTB4R2 | Q9NPC1 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7972959 | 0.93 | MRGPRX4 (0.49) | ALDH1A1GAAABCB1MRGPRX4ADRB2 | |
| SCHEMBL7974213 | 0.88 | ALDH1A1 (0.44) | ALDH1A1GAAABCB1MRGPRX4ADRB2 | |
| SCHEMBL7972678 | 0.82 | ALDH1A1 (0.45) | ALDH1A1GAAABCB1MRGPRX4ADRB2 | |
| SCHEMBL7962739 | 0.79 | ACHE (0.37) | ABCB1KDM4ETNFPDE4APDE4B | |
| SCHEMBL7387393 | 0.77 | KMT2A (0.50) | ALDH1A1GAAABCB1MRGPRX4ADRB2 | |
| SCHEMBL7974197 | 0.74 | MRGPRX4 (0.51) | ALDH1A1GAAABCB1MRGPRX4ADRB2 | |
| SCHEMBL7979062 | 0.74 | ABCB1 (0.54) | ALDH1A1GAAABCB1MRGPRX4ADRB2 | |
| SCHEMBL7383487 | 0.74 | ABCB1 (0.52) | ALDH1A1GAAABCB1MRGPRX4ADRB2 | |
| SCHEMBL20691778 | 0.73 | ALDH1A1 (0.47) | ALDH1A1GAAABCB1MRGPRX4ADRB2 | |
| SCHEMBL7974209 | 0.72 | ABCB1 (0.46) | ALDH1A1GAAABCB1MRGPRX4ADRB2 |
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-6248766-B1 | CARDIOVASCULAR DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-06-19 | — | — | US | disclosed |