Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGIR | P43119 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL11611124 | 0.79 | NPC1 (0.47) | NPC1RAB9AKDM4EHPGDHIF1A | |
| SCHEMBL6608161 | 0.79 | SMN1; SMN2 (0.42) | PTGIRKDM4EHPGDTP53SMN1; SMN2 | |
| SCHEMBL11616738 | 0.79 | MAPK1 (0.45) | RAB9AKDM4EHPGDLMNAPPARG | |
| SCHEMBL11611800 | 0.76 | PTGDR2 (0.45) | NPC1RAB9AKDM4EHPGDPKM | |
| SCHEMBL11614313 | 0.76 | NPC1 (0.44) | NPC1RAB9AKDM4EHPGDPKM | |
| SCHEMBL11612175 | 0.73 | KMT2A (0.45) | NPC1RAB9AKDM4EHPGD | |
| SCHEMBL11616397 | 0.73 | MEN1 (0.41) | PTGIRKDM4ESMN1; SMN2LMNA | |
| SCHEMBL11615339 | 0.72 | KMT2A (0.49) | NPC1RAB9AKDM4ETP53SMN1; SMN2 | |
| SCHEMBL11612842 | 0.72 | KMT2A (0.52) | NPC1RAB9AHPGDPKMSMN1; SMN2 | |
| SCHEMBL8675359 | 0.67 | PKM (0.61) | RAB9APKMLMNAESR1ESR2 |
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-4117145-A | DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-26 | — | — | US | disclosed |
| US-4117143-A | USED AS ANTITHROMBOTIC AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-26 | — | — | US | disclosed |
| US-4113957-A | DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-12 | — | — | US | disclosed |