Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 2/20 | 0.46 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.46 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | CCR5 | P51681 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.35 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7006198 | 0.98 | TNKS (0.45) | TNKSTNKS2AVPR1AKCNH2HDAC1 | |
| SCHEMBL38333 | 0.87 | CYP2C9 (0.46) | TNKSTNKS2AVPR1AKCNH2HDAC1 | |
| Hydrochloric Acid SCHEMBL7012082 | 0.85 | CYP2C9 (0.44) | TNKSTNKS2AVPR1AKCNH2HDAC1 | |
| Hydrochloric Acid SCHEMBL7006808 | 0.84 | TNKS (0.43) | TNKSTNKS2AVPR1AKCNH2HDAC1 | |
| SCHEMBL30412930 | 0.81 | TSHR (0.51) | TNKSTNKS2ALDH1A1KMT2A | |
| SCHEMBL15007673 | 0.81 | TNKS (0.46) | TNKSTNKS2AVPR1AKCNH2HDAC1 | |
| SCHEMBL25436735 | 0.80 | OXTR (0.44) | TNKSTNKS2CCR5CYP2D6MEN1 | |
| SCHEMBL5578474 | 0.80 | SMN1; SMN2 (0.51) | AVPR1ACCR5MEN1ALDH1A1KMT2A | |
| SCHEMBL14624333 | 0.78 | TNKS (0.47) | TNKSTNKS2AVPR1AKCNH2HDAC1 | |
| SCHEMBL29479467 | 0.78 | TNKS (0.44) | TNKSTNKS2AVPR1AKCNH2HDAC1 |
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-1129089-A4 | SPIRO-INDOLINES AS Y5 RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 2003-01-22 | — | — | EP | disclosed |
| EP-1129089-A1 | SPIRO-INDOLINES AS Y5 RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 2001-09-05 | — | — | EP | disclosed |
| WO-2000027845-A1 | SPIRO-INDOLINES AS Y5 RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2000-05-18 | — | — | WO | disclosed |