Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | PON1 | P27169 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.38 |
| ▸ | CHKA | P35790 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL2191910 | 0.98 | KDM4E (0.41) | KDM4EALDH1A1PON1P2RX3CHKA | |
| SCHEMBL16674128 | 0.86 | PON1 (0.46) | ALDH1A1PON1SMN1; SMN2MEN1APAF1 | |
| SCHEMBL12220255 | 0.81 | PON1 (0.43) | PON1CHKASMN1; SMN2MEN1APAF1 | |
| Bromide SCHEMBL2192405 | 0.81 | ALDH1A1 (0.47) | KDM4EALDH1A1TAAR1SMN1; SMN2IDO1 | |
| SCHEMBL16638701 | 0.80 | CYP19A1 (0.47) | ALDH1A1PON1SMN1; SMN2IDO1MEN1 | |
| Iodide SCHEMBL2527838 | 0.80 | PON1 (0.42) | PON1SMN1; SMN2MEN1APAF1NPC1 | |
| SCHEMBL12513967 | 0.78 | CYP11B1 (0.46) | ALDH1A1PON1SMN1; SMN2MEN1APAF1 | |
| SCHEMBL667065 | 0.78 | PON1 (0.50) | PON1SMN1; SMN2MEN1APAF1NPC1 | |
| SCHEMBL31238837 | 0.77 | PON1 (0.47) | PON1SMN1; SMN2MEN1APAF1NPC1 | |
| Iodide SCHEMBL13735543 | 0.77 | PON1 (0.40) | ALDH1A1PON1SMN1; SMN2MEN1APAF1 |
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-2268652-B1 | PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI SA (FR) | 2012-12-19 | — | — | EP | disclosed |
| EP-2268652-A2 | PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | Sanofi-Aventis (FR) | 2011-01-05 | — | — | EP | disclosed |
| WO-2009118475-A2 | PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2009-10-01 | — | — | WO | disclosed |