Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CASP6 | P55212 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9940716 | 0.86 | ALDH1A1 (0.51) | ALDH1A1HTTCYP3A4TSHRCASP6 | |
| SCHEMBL1981547 | 0.85 | ALDH1A1 (0.42) | ALDH1A1HTTMAPK1MAPTLMNA | |
| SCHEMBL268657 | 0.82 | TDP1 (0.57) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL1662886 | 0.80 | ALDH1A1 (0.65) | ALDH1A1HTTCYP3A4TSHRMAPK1 | |
| SCHEMBL16455142 | 0.77 | LMNA (0.52) | ALDH1A1HTTCYP3A4MAPK1MAPT | |
| SCHEMBL4543292 | 0.75 | ALDH1A1 (0.64) | ALDH1A1HTTCYP3A4TSHRCASP6 | |
| SCHEMBL823830 | 0.74 | ALDH1A1 (0.50) | ALDH1A1HTTCYP3A4TSHRCASP6 | |
| SCHEMBL27929922 | 0.73 | PDK1 (0.52) | ALDH1A1CYP3A4TSHRMAPK1MAPT | |
| SCHEMBL9474405 | 0.73 | CASP6 (0.52) | ALDH1A1HTTCYP3A4TSHRCASP6 | |
| SCHEMBL6584963 | 0.72 | TSHR (0.51) | ALDH1A1HTTTSHRMAPTLMNA |
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-102656141-B | Micromolecular compound of simulation hemopoieticgrowth factor and uses thereof | LIGAND PHARMACEUTICALS INC. (US) | 2016-04-06 | — | — | CN | disclosed |