Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.32 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.32 |
| ▸ | MC4R | P32245 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.32 |
| ▸ | GRN | P28799 | 1/20 | 0.32 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.32 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.32 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8067351 | 1.00 | SLC6A2 (0.40) | SLC6A2SLC6A3SLC6A4ALDH1A1LMNA | |
| SCHEMBL8063522 | 0.89 | ALDH1A1 (0.38) | SLC6A2SLC6A3SLC6A4ALDH1A1LMNA | |
| SCHEMBL8063519 | 0.89 | ALDH1A1 (0.38) | SLC6A2SLC6A3SLC6A4ALDH1A1LMNA | |
| SCHEMBL8053297 | 0.80 | SLC6A2 (0.38) | SLC6A2SLC6A3SLC6A4ALDH1A1LMNA | |
| SCHEMBL8053295 | 0.80 | SLC6A2 (0.38) | SLC6A2SLC6A3SLC6A4ALDH1A1LMNA | |
| SCHEMBL8069555 | 0.73 | ALDH1A1 (0.38) | SLC6A2SLC6A3SLC6A4ALDH1A1LMNA | |
| SCHEMBL8067305 | 0.72 | PRKCZ (0.47) | SLC6A2SLC6A3SLC6A4ALDH1A1LMNA | |
| SCHEMBL8067302 | 0.72 | PRKCZ (0.47) | SLC6A2SLC6A3SLC6A4ALDH1A1LMNA | |
| SCHEMBL8580827 | 0.71 | SLC6A2 (0.33) | SLC6A2SLC6A3SLC6A4 | |
| SCHEMBL4677515 | 0.71 | SLC6A3 (0.40) | SLC6A2SLC6A3SLC6A4ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6013652-A | ANTIINFLAMMATORY AGENTS; ANALGESICS; ANTIHISTAMINES | MERCK & CO., INC. (US) | 2000-01-11 | — | — | US | disclosed |
| US-5962462-A | COMPOUNDS WHICH INHIBIT THE ENTRY OF HUMAN IMMUNODEFICIENCY VIRUS (HIV) INTO TARGET CELLS; DELAYING THE ONSET OF ACQUIRED IMMUNE DEFICIENCY SYNDROME (AIDS). | MERCK & CO., INC. (US) | 1999-10-05 | — | — | US | disclosed |
| WO-1998025605-A1 | SPIRO-SUBSTITUTED AZACYCLES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 1998-06-18 | — | — | WO | disclosed |