Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.48 |
| ▸ | CCR5 | P51681 | 3/20 | 0.48 |
| ▸ | CCR8 | P51685 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | METAP1 | P53582 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.35 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.35 |
| ▸ | KDM5C | P41229 | 3/20 | 0.33 |
| ▸ | KDM6B | O15054 | 2/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.33 |
| ▸ | KDM2A | Q9Y2K7 | 2/20 | 0.33 |
| ▸ | KDM3A | Q9Y4C1 | 2/20 | 0.33 |
| ▸ | KDM4A | O75164 | 2/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11198820 | 0.81 | ASIC3 (0.59) | KDM4ELMNACYP1A2ASIC3 | |
| SCHEMBL6363027 | 0.77 | — | — | |
| SCHEMBL22333823 | 0.75 | CYP2A6 (0.64) | CYP1A2 | |
| SCHEMBL11515982 | 0.74 | — | — | |
| SCHEMBL2646552 | 0.72 | — | — | |
| SCHEMBL2643798 | 0.72 | — | — | |
| SCHEMBL28049786 | 0.72 | — | — | |
| SCHEMBL11024887 | 0.72 | — | — | |
| SCHEMBL1145242 | 0.72 | — | — | |
| SCHEMBL25725277 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105503563-B | One kind sulfur-bearing complex of iridium catalysis CO2The method of hydrogenating reduction | 大连理工大学 | 2017-10-17 | — | — | CN | disclosed |
| CN-105503563-A | Method for catalyzing CO2 hydrogenation reduction by using sulfur-containing iridium complex | UNIV DALIAN TECH | 2016-04-20 | — | — | CN | disclosed |