Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 5/20 | 0.54 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.48 |
| ▸ | HTR1A | P08908 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7972957 | 0.93 | ADRB2 (0.57) | ABCB1ADRB2ADRB1ADRB3HTR1A | |
| SCHEMBL7974209 | 0.88 | ABCB1 (0.46) | ABCB1ADRB2ADRB1ADRB3HTR1A | |
| SCHEMBL7962737 | 0.79 | ABCB1 (0.39) | ABCB1ADRB2ADRB1ADRB3HTR1A | |
| SCHEMBL7972678 | 0.79 | ALDH1A1 (0.45) | ABCB1ADRB2ADRB1ADRB3HTR1A | |
| SCHEMBL24510647 | 0.77 | ABCB1 (0.52) | ABCB1ADRB2ADRB1ADRB3HTR1A | |
| SCHEMBL18048469 | 0.76 | ABCB1 (0.59) | ABCB1ADRB2ADRB1ADRB3HTR1A | |
| SCHEMBL7383487 | 0.76 | ABCB1 (0.52) | ABCB1ADRB2ADRB1ADRB3HTR1A | |
| SCHEMBL4817908 | 0.75 | ABCB1 (0.50) | ABCB1ADRB2ADRB1ADRB3HTR1A | |
| SCHEMBL11108220 | 0.75 | ABCB1 (0.67) | ABCB1ADRB2ADRB1ADRB3HTR1A | |
| SCHEMBL11291639 | 0.75 | ABCB1 (0.67) | ABCB1ADRB2ADRB1ADRB3HTR1A |
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 |