Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | GPR132 | Q9UNW8 | 3/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | VNN1 | O95497 | 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 | |
|---|---|---|---|---|
| SCHEMBL7065633 | 0.77 | SIGMAR1 (0.45) | HSD11B1CYP17A1CYP19A1NAPRTTSHR | |
| SCHEMBL6817016 | 0.73 | CHRNB2 (0.41) | HSD11B1CYP17A1CYP19A1KDM4EALDH1A1 | |
| SCHEMBL17033034 | 0.69 | CYP1A2 (0.59) | CYP17A1CYP19A1NAPRTGAAKMT2A | |
| SCHEMBL20137941 | 0.66 | CHRNB2 (0.46) | — | |
| SCHEMBL15578122 | 0.65 | POLB (0.48) | HSD11B1GPR132CYP17A1CYP19A1NAPRT | |
| SCHEMBL4245629 | 0.63 | KMT2A (0.61) | CYP17A1CYP19A1NAPRTKDM4EALDH1A1 | |
| SCHEMBL14351315 | 0.63 | KMT2A (0.53) | CYP17A1CYP19A1NAPRTTSHRGAA | |
| SCHEMBL29556883 | 0.63 | KMT2A (0.53) | CYP17A1CYP19A1NAPRTTSHRGAA | |
| SCHEMBL2045062 | 0.62 | NPC1 (0.59) | HSD11B1TSHRGAAALDH1A1 | |
| SCHEMBL6820957 | 0.62 | ALDH1A1 (0.46) | TSHRGAAALDH1A1KMT2AHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004099185-A1 | 2-CYANOPYRROLIDINE DERIVATIVES AND THEIR USE AS DPP-IV INHIBITORS | FUJISAWA PHARMACEUTICAL CO. LTD. (JP) | 2004-11-18 | — | — | WO | disclosed |