Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | SCN1A | P35498 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | VSIR | Q9H7M9 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4781138 | 0.76 | S1PR1 (0.39) | SIGMAR1S1PR2S1PR4S1PR1S1PR3 | |
| SCHEMBL4780934 | 0.73 | DHODH (0.40) | KCNH2NOS3NOS1NOS2SMN1; SMN2 | |
| SCHEMBL10974964 | 0.65 | SIGMAR1 (0.70) | SIGMAR1KCNH2 | |
| Butylbenzyl SCHEMBL11177070 | 0.64 | SIGMAR1 (0.76) | SIGMAR1KCNH2 | |
| SCHEMBL133622 | 0.64 | MEN1 (0.64) | SIGMAR1TDP1VSIR | |
| SCHEMBL27464581 | 0.63 | HTR2A (0.59) | SIGMAR1KCNH2LMNA | |
| SCHEMBL11411955 | 0.62 | KCNH2 (0.65) | SIGMAR1KCNH2 | |
| Ammonia Solution, Strong SCHEMBL16268586 | 0.62 | MEN1 (0.61) | SIGMAR1TDP1VSIR | |
| Trimethylammonium SCHEMBL11226106 | 0.62 | KCNH2 (0.70) | SIGMAR1KCNH2LMNA | |
| Phosphine SCHEMBL27567281 | 0.62 | KCNH2 (0.69) | SIGMAR1KCNH2LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008009963-A2 | PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS | JAMES BLACK FOUNDATION LIMITED (GB) | 2008-01-24 | — | — | WO | disclosed |