Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | TGM2 | P21980 | 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 | |
|---|---|---|---|---|
| SCHEMBL29409777 | 0.83 | ALDH1A1 (0.45) | TDP1SMN1; SMN2CYP2C19ALDH1A1HSD17B10 | |
| SCHEMBL23653864 | 0.79 | ALDH1A1 (0.50) | TDP1SMN1; SMN2CYP2C19ALDH1A1HSD17B10 | |
| SCHEMBL9614598 | 0.78 | TDP1 (0.48) | TDP1ALDH1A1HSD17B10ALOX15MAPT | |
| SCHEMBL14457019 | 0.78 | ALDH1A1 (0.61) | TDP1SMN1; SMN2CYP2C19ALDH1A1HSD17B10 | |
| SCHEMBL22105323 | 0.76 | TDP1 (0.42) | TDP1SMN1; SMN2CYP2C19ALDH1A1HSD17B10 | |
| SCHEMBL8995845 | 0.75 | CYP2C19 (0.51) | SMN1; SMN2CYP2C19MAPTKDM4ECYP1A2 | |
| SCHEMBL27855225 | 0.72 | SMN1; SMN2 (0.38) | TDP1SMN1; SMN2CYP2C19ALDH1A1HSD17B10 | |
| SCHEMBL7438151 | 0.71 | MAPT (0.50) | TDP1SMN1; SMN2CYP2C19ALDH1A1HSD17B10 | |
| SCHEMBL8520350 | 0.71 | ENPP2 (0.42) | TDP1SMN1; SMN2ALDH1A1HSD17B10ALOX15 | |
| SCHEMBL9614650 | 0.71 | TDP1 (0.44) | TDP1SMN1; SMN2CYP2C19ALDH1A1HSD17B10 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20060223967-A1 | Novel polyurea isocyanates | AIR PRODUCTS AND CHEMICALS, INC. | 2006-10-05 | — | — | US | claimed |
| EP-1707584-A1 | Novel polyurea isocyanates | Air Products and Chemicals, Inc. (US) | 2006-10-04 | — | — | EP | claimed |
| EP-2447294-B1 | Mixed Polycycloaliphatic Amines (MPCA) and MPCA Alkylates | AIR PROD & CHEM (US) | 2017-10-18 | — | — | EP | disclosed |
| US-8759470-B2 | Mixed polycycloaliphatic amines (MPCA) and MPCA alkylates | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2014-06-24 | — | — | US | disclosed |
| EP-2447294-A1 | Mixed Polycycloaliphatic Amines (MPCA) and MPCA Alkylates | Air Products and Chemicals, Inc. (US) | 2012-05-02 | — | — | EP | disclosed |
| US-20100048833-A1 | Mixed Polycycloaliphatic Amines (MPCA) And MPCA Alkylates | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2010-02-25 | — | — | US | disclosed |
| EP-2157110-A2 | Mixed Polycycloaliphatic Amines (MPCA) and MPCA Alkylates | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2010-02-24 | — | — | EP | disclosed |
| US-20060223967-A1 | Novel polyurea isocyanates | AIR PRODUCTS AND CHEMICALS, INC. | 2006-10-05 | — | — | US | disclosed |
| EP-1707584-A1 | Novel polyurea isocyanates | Air Products and Chemicals, Inc. (US) | 2006-10-04 | — | — | EP | disclosed |