Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.93 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.93 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.93 |
| ▸ | MEN1 | O00255 | 2/20 | 0.93 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.93 |
| ▸ | RAB9A | P51151 | 1/20 | 0.93 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.74 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.74 |
| ▸ | FLT3 | P36888 | 4/20 | 0.70 |
| ▸ | LMNA | P02545 | 4/20 | 0.70 |
| ▸ | HPGD | P15428 | 3/20 | 0.70 |
| ▸ | MAPT | P10636 | 4/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | GFER | P55789 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | CDK2 | P24941 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL8288688 | 0.99 | ALDH1A1 (0.91) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 | |
| SCHEMBL3125764 | 0.97 | ALDH1A1 (0.88) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 | |
| SCHEMBL8288697 | 0.96 | ALDH1A1 (0.86) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 | |
| SCHEMBL5457782 | 0.94 | ALDH1A1 (0.95) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 | |
| SCHEMBL4135422 | 0.91 | HPGD (0.83) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 | |
| SCHEMBL5465217 | 0.88 | ALDH1A1 (0.81) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 | |
| SCHEMBL8289510 | 0.86 | ALDH1A1 (0.78) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 | |
| SCHEMBL8289412 | 0.85 | KDM4E (1.00) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 | |
| SCHEMBL17817432 | 0.85 | ALDH1A1 (0.77) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 | |
| SCHEMBL6437345 | 0.85 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPK10 |
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-2005033102-A2 | THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF | AMPHORA DISCOVERY CORPORATION (US) | 2005-04-14 | — | — | WO | disclosed |