Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 4/20 | 0.53 |
| ▸ | NOS2 | P35228 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | NOS3 | P29474 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.51 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.50 |
| ▸ | GLS | O94925 | 2/20 | 0.46 |
| ▸ | PNMT | P11086 | 1/20 | 0.45 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CFD | P00746 | 1/20 | 0.43 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.43 |
| ▸ | KLK1 | P06870 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6509671 | 0.89 | ALDH1A1 (0.46) | ALDH1A1SLC7A5CYP1A2CYP2C19 | |
| SCHEMBL29351393 | 0.84 | CA2 (0.45) | NOS1NOS2SMN1; SMN2ALDH1A1NOS3 | |
| SCHEMBL22265815 | 0.84 | CA2 (0.45) | NOS1NOS2SMN1; SMN2ALDH1A1NOS3 | |
| SCHEMBL28307894 | 0.83 | ENPP2 (0.54) | NOS1NOS2SMN1; SMN2ALDH1A1NOS3 | |
| SCHEMBL12081708 | 0.83 | SMN1; SMN2 (0.38) | NOS1NOS2SMN1; SMN2ALDH1A1NOS3 | |
| SCHEMBL11079658 | 0.83 | KDM4E (0.52) | NOS1NOS2SMN1; SMN2NOS3LOXL2 | |
| SCHEMBL13554933 | 0.82 | ENPP2 (0.44) | SMN1; SMN2ALDH1A1ENPP2SLC7A5TSHR | |
| SCHEMBL13905068 | 0.82 | BCL2 (0.47) | SMN1; SMN2ALDH1A1SLC7A5CYP1A2TSHR | |
| SCHEMBL7770968 | 0.82 | ENPP2 (0.52) | NOS1NOS2SMN1; SMN2ALDH1A1NOS3 | |
| SCHEMBL3803115 | 0.82 | AKR1B1 (0.58) | NOS1NOS2SMN1; SMN2ALDH1A1NOS3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017189342-A1 | INSULIN DIMER-INCRETIN CONJUGATES | MERCK SHARP & DOHME CORP. (US) | 2017-11-02 | — | — | WO | disclosed |
| WO-2017160669-A1 | INSULIN-INCRETIN CONJUGATES | MERCK SHARP & DOHME CORP. (US) | 2017-09-21 | — | — | WO | disclosed |
| CN-101107247-B | Substituted benzoquinolizines as dpp-iv inhibitors for the treatment of diabetes | HOFFMANN LA ROCHE | 2011-10-19 | — | — | CN | disclosed |
| CN-101107247-A | Substituted benzoquinolizines as dpp-iv inhibitors for the treatment of diabetes | HOFFMANN LA ROCHE (CH) | 2008-01-16 | — | — | CN | disclosed |
| EP-0716661-B1 | PSEUDO- AND NON-PEPTIDE BRADYKININ RECEPTOR ANTAGONISTS | SCIOS INC (US) | 2000-04-05 | — | — | EP | disclosed |
| US-5552383-A | ANALGESIC, ANTIINFLAMMATORY FOR WOUNDS | SCIOS NOVA INC. (US) | 1996-09-03 | — | — | US | disclosed |
| US-5541286-A | Bradykinin antagonist pseudopeptide derivatives of olefinic aminoalkanoic acids | SCIOS NOVA INC. (US) | 1996-07-30 | — | — | US | disclosed |
| EP-0716661-A1 | PSEUDO- AND NON-PEPTIDE BRADYKININ RECEPTOR ANTAGONISTS | SCIOS NOVA INC. (US) | 1996-06-19 | — | — | EP | disclosed |
| WO-1995007294-A1 | PSEUDO- AND NON-PEPTIDE BRADYKININ RECEPTOR ANTAGONISTS | SCIOS NOVA INC. (US) | 1995-03-16 | — | — | WO | disclosed |