Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | AGER | Q15109 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2213767 | 0.85 | PARP1 (0.51) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9953506 | 0.84 | PARP1 (0.50) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9569309 | 0.84 | PARP1 (0.50) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL21449055 | 0.83 | KDM4E (0.57) | KDM4EALDH1A1MAPTSMN1; SMN2RAB9A | |
| SCHEMBL31368390 | 0.80 | PARP1 (0.46) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9955204 | 0.78 | PARP1 (0.45) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL30712181 | 0.77 | SMN1; SMN2 (0.41) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL27996476 | 0.77 | KDM4E (0.48) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL29082826 | 0.76 | P2RX7 (0.62) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| Methyl Alcohol SCHEMBL27853401 | 0.76 | TDP1 (0.50) | KDM4EALDH1A1HSD17B10TDP1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-101802599-A | reagent devices | HOFFMANN LA ROCHE | 2010-08-11 | — | — | CN | disclosed |
| CN-101273015-A | 3-cyclyl-2- (4-sulfamo yl-phenyl) -N-cyclyl-propionamide derivatives useful in the treatment of impaired glucose tolerance and diabetes | NOVARTIS AG (CH) | 2008-09-24 | — | — | CN | disclosed |
| CN-101273048-A | Sulfonamide derivatives as glycokinase activators useful in the treatment of type 2 diabetes | NOVARTIS AG (CH) | 2008-09-24 | — | — | CN | disclosed |