Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5657224 | 0.87 | CYP3A4 (0.54) | CYP3A4TRPA1MAPK1TDP1TSHR | |
| SCHEMBL31259927 | 0.81 | ALDH1A1 (0.41) | MAPK1ALDH1A1 | |
| SCHEMBL8853900 | 0.80 | MAPK1 (0.58) | CYP3A4TRPA1MAPK1TDP1TSHR | |
| SCHEMBL5655949 | 0.79 | LMNA (0.36) | CYP3A4TRPA1TDP1L3MBTL1ALDH1A1 | |
| SCHEMBL10866723 | 0.77 | CYP3A4 (0.37) | CYP3A4TRPA1MAPK1TDP1TSHR | |
| SCHEMBL4154539 | 0.77 | TDP1 (0.41) | CYP3A4TRPA1MAPK1TDP1TSHR | |
| SCHEMBL58809 | 0.74 | CYP3A4 (0.70) | CYP3A4TRPA1MAPK1TDP1TSHR | |
| SCHEMBL3282746 | 0.73 | CYP3A4 (0.39) | CYP3A4TRPA1TDP1ALDH1A1CYP1A2 | |
| SCHEMBL395353 | 0.73 | KMT2A (0.43) | CYP3A4TDP1L3MBTL1TSHRALDH1A1 | |
| SCHEMBL29693002 | 0.73 | KMT2A (0.43) | CYP3A4TDP1L3MBTL1TSHRALDH1A1 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100513389-C | Improved process for the production of carbodiimide modifiedorganic isocyanates | BAYER MATERIALSCIENCE LLC (US) | 2009-07-15 | — | — | CN | disclosed |
| US-7030274-B2 | Process for the production of carbodiimide modified organic isocyanates | BAYER MATERIALSCIENCE LLC (US) | 2006-04-18 | — | — | US | disclosed |
| US-20050282993-A1 | Process for the production of carbodiimide modified organic isocyanates | COVESTRO LLC | 2005-12-22 | — | — | US | disclosed |
| EP-1607425-A1 | Process for the production of carboiimide modified organic isocyanates | Bayer MaterialScience LLC (US) | 2005-12-21 | — | — | EP | disclosed |
| CN-1709863-A | Improved process for the production of carbodiimide modifiedorganic isocyanates | BAYER MATERIALSCIENCE LLC (US) | 2005-12-21 | — | — | CN | disclosed |
| US-6362247-B1 | DEACTIVATION PHOSPHOLENE CATALYSTS | ROHM AND HAAS COMPANY | 2002-03-26 | — | — | US | disclosed |
| EP-1054029-A1 | Method of improving stability of aromatic polycarbodimides | ROHM AND HAAS COMPANY (US) | 2000-11-22 | — | — | EP | disclosed |
| CN-1273980-A | Method of improving stability of aromatic polycarbodi-imide | ROHM & HAAS (US) | 2000-11-22 | — | — | CN | disclosed |
| US-5045226-A | Reaction product of tin compound with sulfonyl isocyanate, storage stability, polyurethanes | BAYER AKTIENGESELLSCHAFT (DE) | 1991-09-03 | — | — | US | disclosed |
| US-4824595-A | Polyisocyanate compositions containing reversibly blocked catalysts and addition products of sulfonyl isocyanates with catalysts having a tin(II)- or tin(IV)-carboxylate structure | BAYER AKTIENGESELLSCHAFT (DE) | 1989-04-25 | — | — | US | disclosed |
| US-4638795-A | FOR MEDICAL AND VETERINARY USE; BASED ON POLYURETHANES | BAYER AKTIENGESELLSCHAFT (DE) | 1987-01-27 | — | — | US | disclosed |
| US-4614785-A | TERTIARY PHOSPHINE OR PERALKYLATED PHOSPHORUS ACID TRIAMIDE CATALYST | BAYER AKTIENGESELLSCHAFT (DE) | 1986-09-30 | — | — | US | disclosed |