Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GALR3 | O60755 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | NOX4 | Q9NPH5 | 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 | |
|---|---|---|---|---|
| SCHEMBL30252315 | 0.94 | CYP19A1 (0.43) | TSHRCYP19A1FFAR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL5728797 | 0.94 | CYP19A1 (0.43) | TSHRCYP19A1FFAR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL7412881 | 0.82 | CYP19A1 (0.41) | TSHRCYP19A1FFAR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL2154210 | 0.81 | SMN1; SMN2 (0.49) | TSHRCYP19A1FFAR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL29633128 | 0.79 | CYP19A1 (0.39) | TSHRCYP19A1FFAR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27532550 | 0.79 | ESR2 (0.42) | TSHRCYP19A1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL30129807 | 0.78 | FFAR1 (0.44) | TSHRCYP19A1FFAR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL3632404 | 0.78 | TSHR (0.46) | TSHRCYP19A1FFAR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL536176 | 0.78 | FFAR1 (0.44) | TSHRCYP19A1FFAR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL29513232 | 0.77 | CYP19A1 (0.46) | TSHRCYP19A1FFAR1ALDH1A1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| CN-101386590-A | Pyrrolidone containing hydroxymethyl and carboxyl, preparation method and medicament composition and use thereof | INST MATERIA MEDICA CAMS (CN) | 2009-03-18 | — | — | CN | disclosed |