Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UTS2R | Q9UKP6 | 9/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 8/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27544631 | 0.82 | HPGD (0.41) | CYP3A4CYP2D6SIGMAR1POLBSMN1; SMN2 | |
| SCHEMBL1933552 | 0.80 | ALDH1A1 (0.42) | CYP3A4CYP2D6SIGMAR1POLBSMN1; SMN2 | |
| SCHEMBL11820260 | 0.78 | ALDH1A1 (0.44) | CYP3A4CYP2D6SIGMAR1POLBSMN1; SMN2 | |
| SCHEMBL6734448 | 0.74 | ALDH1A1 (0.36) | CHRM2CHRM3POLBSMN1; SMN2HPGD | |
| SCHEMBL473405 | 0.65 | ALDH1A1 (0.40) | CYP3A4CYP2D6SIGMAR1POLBSMN1; SMN2 | |
| SCHEMBL2091976 | 0.63 | NPSR1 (0.47) | CHRM2CHRM3POLBMEN1KMT2A | |
| SCHEMBL11771602 | 0.63 | ADORA3 (0.37) | UTS2ROPRK1CYP3A4CYP2D6CHRM2 | |
| SCHEMBL9864709 | 0.62 | CTSK (0.38) | CYP3A4CYP2D6POLBSMN1; SMN2MEN1 | |
| SCHEMBL11035980 | 0.62 | ALDH1A1 (0.37) | CYP3A4CYP2D6POLBSMN1; SMN2MEN1 | |
| SCHEMBL2091974 | 0.62 | NPSR1 (0.45) | CHRM2CHRM3POLBKMT2AGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1881975-A1 | N,N-SUBSTITUTED 3-AMINOPYRROLIDINE COMPOUNDS USEFUL AS MONOAMINES REUPTAKE INHIBITORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2008-01-30 | — | — | EP | disclosed |
| WO-2006121218-A1 | N,N-SUBSTITUTED 3-AMINOPYRROLIDINE COMPOUNDS USEFUL AS MONOAMINES REUPTAKE INHIBITORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2006-11-16 | — | — | WO | disclosed |