Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 10/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 10/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 10/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 8/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 8/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 8/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6825996 | 0.81 | CHRM2 (0.42) | DRD4SIGMAR1NPC1RAB9AMAOA | |
| SCHEMBL6825995 | 0.78 | DRD4 (0.33) | DRD4SIGMAR1GABRG2GABRB3GABRA5 | |
| SCHEMBL17193340 | 0.74 | NPC1 (0.60) | SIGMAR1NPC1RAB9AMAOAMAOB | |
| SCHEMBL2588526 | 0.68 | DRD4 (0.53) | DRD4SIGMAR1GABRG2GABRB3GABRA5 | |
| SCHEMBL791993 | 0.67 | CCR1 (0.44) | DRD4SIGMAR1GABRG2GABRB3GABRA5 | |
| SCHEMBL12949141 | 0.67 | CHRM3 (0.37) | — | |
| SCHEMBL2575841 | 0.67 | DRD4 (0.52) | DRD4SIGMAR1GABRG2GABRB3GABRA5 | |
| SCHEMBL16233606 | 0.66 | ALDH1A1 (0.35) | — | |
| SCHEMBL6820484 | 0.66 | SYK (0.39) | DRD4SIGMAR1GABRG2GABRB3GABRA5 | |
| SCHEMBL13911825 | 0.66 | ALDH1A1 (0.34) | — |
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 |