Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 4/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 2/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | DRD1 | P21728 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
| ▸ | DRD5 | P21918 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.51 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7826888 | 1.00 | SLC18A3 (0.66) | SLC18A3KMT2AALDH1A1LMNAGAA | |
| SCHEMBL7828092 | 1.00 | SLC18A3 (0.66) | SLC18A3KMT2AALDH1A1LMNAGAA | |
| SCHEMBL8967407 | 0.90 | SLC18A3 (0.73) | SLC18A3KMT2ADRD2SIGMAR1MEN1 | |
| SCHEMBL25366560 | 0.85 | SLC18A3 (0.83) | SLC18A3KMT2AALDH1A1LMNAGAA | |
| SCHEMBL19493848 | 0.85 | SLC18A3 (0.83) | SLC18A3KMT2AALDH1A1LMNAGAA | |
| SCHEMBL8967515 | 0.81 | SLC18A3 (0.49) | SLC18A3KMT2AALDH1A1LMNAGAA | |
| SCHEMBL9912160 | 0.81 | DRD2 (0.66) | SLC18A3KMT2AALDH1A1LMNAGAA | |
| SCHEMBL22307922 | 0.81 | DRD2 (0.66) | SLC18A3KMT2AALDH1A1LMNAGAA | |
| SCHEMBL23374660 | 0.81 | DRD2 (0.66) | SLC18A3KMT2AALDH1A1LMNAGAA | |
| SCHEMBL12209849 | 0.80 | ALDH1A1 (0.60) | SLC18A3KMT2AALDH1A1LMNAGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1009405-A4 | PYRROLIDINE AND PIPERIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO INC (US) | 2001-05-09 | — | — | EP | disclosed |
| EP-1009405-A1 | PYRROLIDINE AND PIPERIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Merck & Co., Inc. (US) | 2000-06-21 | — | — | EP | disclosed |
| WO-1999009984-A1 | PYRROLIDINE AND PIPERIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 1999-03-04 | — | — | WO | disclosed |