Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SCN4A | P35499 | 1/20 | 0.32 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | RET | P07949 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8378960 | 0.85 | POLB (0.37) | HTR2AHTR6KDM4EALDH1A1POLB | |
| SCHEMBL30105986 | 0.81 | P2RX4 (0.40) | HTR2AKDM4EALDH1A1POLBCYP2D6 | |
| SCHEMBL7860482 | 0.81 | P2RX4 (0.40) | HTR2AKDM4EALDH1A1POLBCYP2D6 | |
| SCHEMBL3246036 | 0.81 | ATM (0.40) | HTR2AHTR6KDM4EALDH1A1POLB | |
| SCHEMBL31068436 | 0.80 | HTR6 (0.41) | HTR2AHTR6KDM4EALDH1A1POLB | |
| SCHEMBL9309445 | 0.80 | HTR2A (0.38) | HTR2AHTR6KDM4EALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL28109987 | 0.79 | ATM (0.39) | HTR2AHTR6KDM4EALDH1A1POLB | |
| SCHEMBL29096390 | 0.79 | SMN1; SMN2 (0.35) | HTR2AHTR6KDM4EALDH1A1POLB | |
| SCHEMBL9755452 | 0.79 | P2RX4 (0.34) | HTR2AHTR6KDM4EALDH1A1POLB | |
| SCHEMBL27628368 | 0.79 | ALDH1A1 (0.42) | KDM4EALDH1A1POLBATMCYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104072486-A | BI-1H-BENZIMIDAZOLES AS HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO | 2014-10-01 | — | — | CN | disclosed |
| CN-102177141-B | bis-1H-benzimidazoles as hepatitis C virus inhibitors | BRISTOL MYERS SQUIBB CO | 2014-07-23 | — | — | CN | disclosed |