Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.76 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.60 |
| ▸ | HTR1A | P08908 | 2/20 | 0.60 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.57 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.57 |
| ▸ | CCR3 | P51677 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10415385 | 0.99 | ACHE (0.74) | ACHESIGMAR1HTR1APRMT5WDR77 | |
| Hydrochloric Acid SCHEMBL9633667 | 0.90 | ACHE (0.64) | ACHESIGMAR1HTR1ACCR3 | |
| SCHEMBL10483079 | 0.89 | MAPT (0.62) | ACHESIGMAR1HTR1APRMT5WDR77 | |
| SCHEMBL10415375 | 0.86 | ACHE (0.58) | ACHESIGMAR1HTR1APRMT5WDR77 | |
| SCHEMBL38653916 | 0.85 | DRD2 (0.59) | ACHEPRMT5WDR77 | |
| SCHEMBL10416145 | 0.83 | ACHE (0.55) | ACHESIGMAR1HTR1APRMT5WDR77 | |
| Fumaric Acid SCHEMBL10415402 | 0.83 | ACHE (0.55) | ACHE | |
| Fumaric Acid SCHEMBL10414747 | 0.83 | ACHE (0.55) | ACHE | |
| SCHEMBL31134754 | 0.83 | ACHE (0.66) | ACHESIGMAR1PRMT5WDR77 | |
| SCHEMBL10978742 | 0.83 | ACHE (0.66) | ACHESIGMAR1PRMT5WDR77 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1173170-A4 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO INC (US) | 2002-05-29 | — | — | EP | disclosed |
| EP-1173170-A1 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Merck & Co., Inc. (US) | 2002-01-23 | — | — | EP | disclosed |
| US-6265434-B1 | ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. | 2001-07-24 | — | — | US | disclosed |
| WO-2000059503-A1 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2000-10-12 | — | — | WO | disclosed |