Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | PHGDH | O43175 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.44 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8992021 | 0.83 | PHGDH (0.51) | TSHRPHGDHHPGDALDH1A1LMNA | |
| SCHEMBL10420577 | 0.83 | PHGDH (0.51) | TSHRPHGDHHPGDALDH1A1LMNA | |
| SCHEMBL8992020 | 0.83 | PHGDH (0.51) | TSHRPHGDHHPGDALDH1A1LMNA | |
| SCHEMBL10419001 | 0.78 | RAB9A (0.53) | TSHRPHGDHHPGDALDH1A1LMNA | |
| SCHEMBL8884084 | 0.78 | RAB9A (0.53) | TSHRPHGDHHPGDALDH1A1LMNA | |
| SCHEMBL8662309 | 0.76 | TSHR (0.56) | TSHRPHGDHHPGDALDH1A1LMNA | |
| SCHEMBL8884271 | 0.75 | PHGDH (0.44) | TSHRPHGDHHPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL8883608 | 0.73 | FKBP1A (0.48) | TSHRPHGDHHPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL7717729 | 0.72 | ALDH1A1 (0.64) | TSHRPHGDHHPGDALDH1A1LMNA | |
| SCHEMBL8103321 | 0.72 | TSHR (0.41) | TSHRPHGDHHPGDALDH1A1LMNA |
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-2022129113-A1 | NITROGENOUS HETEROAROMATIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2022-06-23 | — | — | WO | disclosed |