Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | DRD2 | P14416 | 2/20 | 0.54 |
| ▸ | DRD4 | P21917 | 2/20 | 0.54 |
| ▸ | DRD3 | P35462 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.53 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9632340 | 0.95 | LTA4H (0.55) | SMN1; SMN2LMNADRD2DRD4DRD3 | |
| SCHEMBL17164056 | 0.95 | DRD2 (0.57) | SMN1; SMN2LMNADRD2DRD4DRD3 | |
| SCHEMBL10829128 | 0.90 | LTA4H (0.57) | SMN1; SMN2LMNADRD2DRD4DRD3 | |
| SCHEMBL5113209 | 0.84 | MTNR1A (0.73) | SMN1; SMN2LMNADRD2DRD4DRD3 | |
| SCHEMBL31483051 | 0.84 | SMN1; SMN2 (0.53) | SMN1; SMN2LMNADRD2DRD4DRD3 | |
| SCHEMBL25268396 | 0.84 | DRD4 (0.57) | SMN1; SMN2DRD2DRD4DRD3MAPK1 | |
| SCHEMBL21595955 | 0.84 | NPC1 (0.73) | SMN1; SMN2DRD2DRD4DRD3MAPK1 | |
| SCHEMBL3446802 | 0.83 | MTNR1A (0.73) | SMN1; SMN2LMNADRD2DRD4DRD3 | |
| SCHEMBL21596070 | 0.82 | MTNR1A (0.75) | SMN1; SMN2DRD2DRD4DRD3MAPK1 | |
| SCHEMBL7094090 | 0.82 | MTNR1A (0.53) | SMN1; SMN2MAPK1NPSR1MTNR1AMTNR1B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019244066-A2 | PYRIDIN-3-YL ACETIC ACID DERIVATIVES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV Healthcare UK (No.5) Limited (GB) | 2019-12-26 | — | — | WO | disclosed |
| WO-2010007482-A2 | THIAZOLE DERIVATIVES AS STEAROYL COA DESATURASE INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2010-01-21 | — | — | WO | disclosed |