Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.41 |
| ▸ | HTR3B | O95264 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.41 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.41 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.40 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11727190 | 0.99 | KDR (0.43) | KDRNOTUMS1PR1HTR3EHTR3B | |
| Hydrochloric Acid SCHEMBL11727439 | 0.85 | KDR (0.40) | KDRNOTUMS1PR1HTR3EHTR3B | |
| SCHEMBL17060479 | 0.83 | HTR3E (0.47) | KDRS1PR1HTR3EHTR3BHTR3A | |
| Hydrochloric Acid SCHEMBL11720486 | 0.82 | HDAC8 (0.41) | GRM4GRIN2BKLRK1MICA | |
| SCHEMBL11257421 | 0.81 | APEX1 (0.45) | LMNA | |
| SCHEMBL11564290 | 0.80 | S1PR1 (0.43) | KDRNOTUMS1PR1PDK1LMNA | |
| SCHEMBL11252696 | 0.80 | GPBAR1 (0.38) | S1PR1LMNASMN1; SMN2NPSR1 | |
| Hydrochloric Acid SCHEMBL11639231 | 0.80 | APEX1 (0.44) | LMNA | |
| SCHEMBL6881686 | 0.79 | KDR (0.41) | KDRNOTUMS1PR1HTR3EHTR3B | |
| SCHEMBL11253129 | 0.79 | LIPE (0.39) | SMN1; SMN2NPSR1BRAF |
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 |
|---|---|---|---|---|---|---|---|
| US-4358611-A | FROM A PHENYLHYDRAZINE, A CHLOROFORMATE, PHOSGENE AND A SECONDARY AMINE | SHELL OIL COMPANY (US) | 1982-11-09 | — | — | US | claimed |
| US-4358611-A | FROM A PHENYLHYDRAZINE, A CHLOROFORMATE, PHOSGENE AND A SECONDARY AMINE | SHELL OIL COMPANY (US) | 1982-11-09 | — | — | US | disclosed |
| US-4099956-A | Herbicidal semicarbazones | SHELL OIL COMPANY (US) | 1978-07-11 | — | — | US | disclosed |