Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.46 |
| ▸ | RXRB | P28702 | 1/20 | 0.46 |
| ▸ | RXRG | P48443 | 1/20 | 0.46 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4784102 | 0.90 | MAOB (0.59) | MAOBPTPN1LMNAHPGDMRGPRX4 | |
| SCHEMBL7178694 | 0.86 | SLC16A3 (0.46) | MAOBMEN1KMT2AMCL1LTB4R | |
| SCHEMBL9191607 | 0.83 | DHODH (0.49) | PTPN1LMNAHPGDMRGPRX4PTGER1 | |
| SCHEMBL27678664 | 0.82 | PTGER1 (0.51) | MAOBPTPN1LMNAHPGDMRGPRX4 | |
| SCHEMBL262646 | 0.82 | MEN1 (0.63) | PTPN1LMNAHPGDMRGPRX4PTGER1 | |
| SCHEMBL10698086 | 0.82 | MCL1 (0.56) | PTPN1LMNAHPGDMRGPRX4PTGER1 | |
| Hydrochloric Acid SCHEMBL16143479 | 0.81 | MEN1 (0.61) | PTPN1LMNAHPGDMRGPRX4PTGER1 | |
| SCHEMBL4308031 | 0.81 | MEN1 (0.65) | LMNAHPGDMRGPRX4MEN1KMT2A | |
| SCHEMBL14856441 | 0.80 | MAPT (0.55) | MAOBPTPN1LMNAHPGDPTGER1 | |
| SCHEMBL7262183 | 0.80 | MAOB (0.54) | MAOBPTPN1LMNAHPGDMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6214879-B1 | Allosteric inhibitors of pyruvate kinase | VIRGINIA COMMONWEALTH UNIVERSITY | 2001-04-10 | — | — | US | disclosed |
| WO-1999048490-A1 | ALLOSTERIC INHIBITORS AND ACTIVATORS OF PYRUVATE KINASE | ALLOS THERAPEUTICS, INC. (US) | 1999-09-30 | — | — | WO | disclosed |
| US-5599974-A | ALDEHYDE AND ACID CONTAINING COMPOUNDS BOND WITH VALINE, ARGININE, AND LYSINE OF HEMOGLOBIN MOLECULE TO MODIFY MOLECULE | CENTER FOR INNOVATIVE TECHNOLOGY (US) | 1997-02-04 | — | — | US | disclosed |