Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | PYGL | P06737 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6558474 | 0.91 | TSHR (0.46) | TSHRSMN1; SMN2PYGLHTTMAPT | |
| SCHEMBL6557397 | 0.91 | TSHR (0.46) | TSHRSMN1; SMN2PYGLHTTMAPT | |
| SCHEMBL6557419 | 0.90 | TSHR (0.45) | TSHRSMN1; SMN2PYGLHTTMAPT | |
| SCHEMBL6557549 | 0.86 | HTT (0.46) | TSHREGLN1SMN1; SMN2HTTKMT2A | |
| SCHEMBL752442 | 0.82 | TSHR (0.47) | TSHRSMN1; SMN2PYGLMAPTACACB | |
| SCHEMBL753192 | 0.81 | TSHR (0.51) | TSHRSMN1; SMN2HTTMAPTKMT2A | |
| SCHEMBL1759206 | 0.73 | TSHR (0.55) | TSHRSMN1; SMN2HTTMAPTKMT2A | |
| SCHEMBL4624413 | 0.73 | TSHR (0.55) | TSHRSMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL754896 | 0.73 | TSHR (0.55) | TSHRSMN1; SMN2HTTMAPTKMT2A | |
| SCHEMBL3584989 | 0.72 | ABL1 (0.42) | SMN1; SMN2MAPTKMT2ARAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1085010-B1 | PHENYLACETYLENE DERIVATIVES AND AGRICULTURAL/HORTICULTURAL BACTERICIDES | KUMIAI CHEMICAL INDUSTRY CO (JP) | 2004-03-10 | — | — | EP | disclosed |
| US-6313071-B1 | Phenylacetylene derivatives and agricultural/horticultural fungicides | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2001-11-06 | — | — | US | disclosed |
| EP-1085010-A1 | PHENYLACETYLENE DERIVATIVES AND AGRICULTURAL/HORTICULTURAL BACTERICIDES | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2001-03-21 | — | — | EP | disclosed |