Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR52 | Q9Y2T5 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL146891 | 0.87 | HDAC3 (0.45) | TDP1SMN1; SMN2HTR2AMAOAMAOB | |
| SCHEMBL11250439 | 0.82 | MAOB (0.42) | GPR52ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL10454344 | 0.79 | FFAR1 (0.40) | GPR52SMN1; SMN2HDAC3MAPK1ADRA1A | |
| SCHEMBL14297904 | 0.78 | CYP1A2 (0.45) | GPR52ALDH1A1ALOX15TDP1SMN1; SMN2 | |
| SCHEMBL21504037 | 0.78 | TAAR1 (0.45) | HTR2ATAAR1LOXL2MAOAMAOB | |
| SCHEMBL5523553 | 0.77 | MIF (0.47) | GPR52ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL3035505 | 0.77 | MAOB (0.42) | GPR52ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL21504040 | 0.77 | TAAR1 (0.52) | ALDH1A1HPGDSMN1; SMN2TAAR1 | |
| SCHEMBL57808 | 0.76 | MAOB (0.52) | LOXL2CA1CA2MAOB | |
| SCHEMBL43326 | 0.75 | MAOA (0.50) | ALDH1A1HPGDALOX15ALOX12CASP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1666548-B1 | Phase change inks containing trans-1,2-cyclohexane bis(urea-urethane) compounds | XEROX CORP (US) | 2008-01-09 | — | — | EP | disclosed |
| CN-1096796-A | The preparation method of urethane foam | EASTMAN KODAK CO (US) | 1994-12-28 | — | — | CN | disclosed |
| US-3997500-A | ADDITION POLYMER | THE DOW CHEMICAL COMPANY (US) | 1976-12-14 | — | — | US | disclosed |
| US-3955027-A | FLUOROCARBON POLYMERS, EXTENDERS | THE DOW CHEMICAL COMPANY (US) | 1976-05-04 | — | — | US | disclosed |
| US-3932318-A | COPOLYMERS WITH ISOCYANATES, CRYOGENIC POLYMERIZATION, NONFLAMMABLE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-01-13 | — | — | US | disclosed |