Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL7719485 | 0.94 | DNM1 (0.40) | CA12CA2CA9CA3CA4 | |
| SCHEMBL7719123 | 0.88 | CHRM2 (0.43) | CA12CA2CA9DNM1MEN1 | |
| SCHEMBL8081020 | 0.87 | LTA4H (0.41) | CA12CA2CA9DNM1LTA4H | |
| SCHEMBL7718808 | 0.86 | CA12 (0.44) | CA12CA2CA9DNM1MEN1 | |
| SCHEMBL31556031 | 0.80 | DNM1 (0.49) | CA12CA2CA9CA3CA4 | |
| SCHEMBL18827666 | 0.77 | CA12 (0.61) | CA12CA2CA9CA3CA4 | |
| SCHEMBL6901589 | 0.77 | CA12 (0.61) | CA12CA2CA9CA3CA4 | |
| SCHEMBL2449256 | 0.74 | ALDH1A1 (0.37) | MEN1KMT2AKDM4EALDH1A1BLM | |
| SCHEMBL25477639 | 0.74 | CA12 (0.50) | CA12CA2CA9CA3CA4 | |
| SCHEMBL25477638 | 0.74 | CA12 (0.50) | CA12CA2CA9CA3CA4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6380274-B1 | REACTING AN ORGANIC POLYISOCYANATE WITH A COMPOUND HAVING A REACTIVE HYDROGEN IN THE PRESENCE OF ALKOXY AMIDE COMPOUND AS CATALYST TO PRODUCE POLYURETHANE | AIR PRODUCTS AND CHEMICALS, INC. | 2002-04-30 | — | — | US | disclosed |
| US-6313346-B1 | Catalyst compositions for the production of polyurethanes | AIR PRODUCTS AND CHEMICALS, INC. | 2001-11-06 | — | — | US | disclosed |
| JP-2000309620-A | NEW CATALYTIC COMPOSITION FOR PRODUCING POLYURETHANE | AIR PROD AND CHEM INC | 2000-11-07 | — | — | JP | disclosed |
| EP-1038894-A2 | New catalyst compositions for the production of polyurethanes | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2000-09-27 | — | — | EP | disclosed |