Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.48 |
| ▸ | BRD4 | O60885 | 3/20 | 0.46 |
| ▸ | TNF | P01375 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.44 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL6170220 | 0.79 | MAPT (0.55) | P2RX7BRD4TNFKDM4ENOD2 | |
| SCHEMBL8597440 | 0.76 | KDM4E (0.40) | P2RX7KDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL1585672 | 0.74 | BRD4 (0.54) | P2RX7BRD4KDM4ENOD2NOD1 | |
| SCHEMBL8601890 | 0.74 | TNF (0.46) | TNFKDM4ESMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL30207788 | 0.71 | PDK1 (0.54) | KDM4EALDH1A1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL3790475 | 0.71 | PDK1 (0.54) | KDM4EALDH1A1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL8603647 | 0.71 | MEN1 (0.40) | MAPTSMN1; SMN2CYP3A4LCKHTT | |
| SCHEMBL1160053 | 0.71 | ALOX5AP (0.49) | TNFKDM4ENOD2NOD1PPARG | |
| Hydrochloric Acid SCHEMBL8595615 | 0.70 | MEN1 (0.39) | MAPTSMN1; SMN2CYP3A4LCKHTT | |
| SCHEMBL476879 | 0.70 | ALDH1A1 (0.66) | P2RX7KDM4EALDH1A1MAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6369092-B1 | Method for treating neoplasia by exposure to substituted benzimidazole derivatives | CELL PATHWAYS, INC. | 2002-04-09 | — | — | US | disclosed |