Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | EEF2K | O00418 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 4/20 | 0.35 |
| ▸ | DRD4 | P21917 | 4/20 | 0.35 |
| ▸ | DRD3 | P35462 | 4/20 | 0.35 |
| ▸ | HTR2A | P28223 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19229626 | 0.78 | GRIN2B (0.49) | HPGDKLKB1CYP19A1CYP1A2SMN1; SMN2 | |
| SCHEMBL17712366 | 0.78 | GRIN2B (0.49) | HPGDKLKB1CYP19A1CYP1A2SMN1; SMN2 | |
| SCHEMBL20485072 | 0.78 | GRIN2B (0.49) | HPGDKLKB1CYP19A1CYP1A2SMN1; SMN2 | |
| SCHEMBL21467087 | 0.75 | CYP19A1 (0.39) | HPGDKLKB1CYP19A1CYP1A2SMN1; SMN2 | |
| SCHEMBL6071882 | 0.71 | CYP19A1 (0.45) | HPGDKLKB1CYP19A1CYP1A2SMN1; SMN2 | |
| SCHEMBL6071728 | 0.70 | CYP19A1 (0.48) | HPGDKLKB1CYP19A1CYP1A2SMN1; SMN2 | |
| SCHEMBL21467098 | 0.70 | LMNA (0.48) | LMNACA12CA1CA2CA3 | |
| SCHEMBL15924211 | 0.69 | HPGD (0.60) | HPGDKLKB1CYP19A1CYP1A2SMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL8834496 | 0.67 | CYP2C9 (0.41) | HPGDKLKB1CYP19A1CYP1A2SMN1; SMN2 | |
| SCHEMBL795210 | 0.67 | HPGD (0.68) | HPGDKLKB1CYP19A1CYP1A2SMN1; SMN2 |
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-2014120783-A1 | SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF | NAUREX, INC. (US) | 2014-08-07 | — | — | WO | disclosed |