Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 6/20 | 0.58 |
| ▸ | HTR2A | P28223 | 4/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.58 |
| ▸ | HTR2B | P41595 | 2/20 | 0.58 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.58 |
| ▸ | HTR1A | P08908 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.58 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.58 |
| ▸ | HRH1 | P35367 | 1/20 | 0.55 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | HTR3A | P46098 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.45 |
| ▸ | HTR1B | P28222 | 1/20 | 0.45 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.43 |
| ▸ | EPHA2 | P29317 | 3/20 | 0.42 |
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 SCHEMBL4497108 | 0.83 | SLC6A4 (0.69) | SLC6A4HTR2ASLC6A2SLC6A3HTR2B | |
| SCHEMBL14417549 | 0.82 | ALDH1A1 (0.51) | SLC6A4SLC6A2SLC6A3ADRB2CYP3A4 | |
| SCHEMBL5514057 | 0.82 | ALDH1A1 (0.51) | SLC6A4SLC6A2SLC6A3ADRB2CYP3A4 | |
| SCHEMBL5514059 | 0.82 | ALDH1A1 (0.51) | SLC6A4SLC6A2SLC6A3ADRB2CYP3A4 | |
| SCHEMBL3193819 | 0.80 | SLC6A4 (0.64) | SLC6A4HTR2ASLC6A2SLC6A3HTR2B | |
| Hydrochloric Acid SCHEMBL4510800 | 0.75 | SLC6A4 (0.58) | SLC6A4HTR2ASLC6A2SLC6A3HTR2B | |
| SCHEMBL3162908 | 0.75 | SLC6A4 (0.59) | SLC6A4HTR2ASLC6A2SLC6A3HTR2B | |
| SCHEMBL15062036 | 0.75 | SLC6A4 (0.77) | SLC6A4HTR2ASLC6A2SLC6A3HTR2B | |
| SCHEMBL9527587 | 0.75 | HTR2A (0.57) | SLC6A4HTR2ASLC6A2SLC6A3HTR2B | |
| SCHEMBL9527580 | 0.75 | HTR2A (0.57) | SLC6A4HTR2ASLC6A2SLC6A3HTR2B |
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-1104411-A4 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORP (US) | 2002-10-24 | — | — | EP | disclosed |
| US-6335338-B1 | Calcilytic compounds | SMITHKLINE BEECHAM CORPORATION | 2002-01-01 | — | — | US | disclosed |
| EP-1104411-A1 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-06-06 | — | — | EP | disclosed |
| WO-2000009491-A1 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-02-24 | — | — | WO | disclosed |