Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.58 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | LIN28A | Q9H9Z2 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL18042405 | 0.98 | HRH1 (0.61) | HRH1SIGMAR1KDM4ETSHRTDP1 | |
| SCHEMBL2681263 | 0.94 | HRH1 (0.55) | HRH1KDM4ETSHRTDP1NPSR1 | |
| SCHEMBL30086100 | 0.86 | KDM4E (0.58) | HRH1KDM4ETSHRTDP1NPSR1 | |
| SCHEMBL229256 | 0.86 | KDM4E (0.58) | HRH1KDM4ETSHRTDP1NPSR1 | |
| Hydrochloric Acid SCHEMBL29367467 | 0.85 | KDM4E (0.57) | HRH1KDM4ETSHRTDP1NPSR1 | |
| SCHEMBL726512 | 0.84 | HRH1 (0.76) | HRH1TDP1HRH3NAAACYP2C19 | |
| SCHEMBL23761760 | 0.83 | HRH1 (0.51) | HRH1KDM4ETSHRTDP1NPSR1 | |
| SCHEMBL4418086 | 0.82 | HRH1 (0.80) | HRH1TDP1HRH3NAAACYP2C19 | |
| SCHEMBL2843489 | 0.82 | HRH1 (0.80) | HRH1TDP1HRH3NAAACYP2C19 | |
| SCHEMBL31040594 | 0.82 | HRH1 (0.80) | HRH1TDP1HRH3NAAACYP2C19 |
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-1069901-A4 | CALCILYTIC COMPOUNDS AND METHOD OF USE | SMITHKLINE BEECHAM CORP (US) | 2001-06-13 | — | — | EP | disclosed |
| EP-1069901-A1 | CALCILYTIC COMPOUNDS AND METHOD OF USE | SMITHKLINE BEECHAM CORPORATION (US) | 2001-01-24 | — | — | EP | disclosed |
| WO-1999051241-A1 | CALCILYTIC COMPOUNDS AND METHOD OF USE | SMITHKLINE BEECHAM CORPORATION (US) | 1999-10-14 | — | — | WO | disclosed |