Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAD52 | P43351 | 1/20 | 0.51 |
| ▸ | UBE2N | P61088 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.43 |
| ▸ | CBFB | Q13951 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10918546 | 0.90 | CACNA1H (0.43) | RAD52UBE2NTDP1HDAC1GAA | |
| SCHEMBL10918448 | 0.80 | PIN1 (0.50) | HDAC1ALDH1A1ALOX15MEN1TP53 | |
| SCHEMBL10919295 | 0.78 | TBXAS1 (0.43) | RAD52UBE2NHDAC1ALDH1A1ALOX15 | |
| SCHEMBL7806832 | 0.75 | CHEK2 (0.51) | TDP1NPSR1GRIN1GRIN2B | |
| SCHEMBL3335641 | 0.75 | GAA (0.71) | GAATSHRCACNA1HKDM4EGRIN1 | |
| Hydrochloric Acid SCHEMBL8477383 | 0.74 | TDP1 (0.48) | RAD52TDP1HDAC1GAAPKM | |
| Hydrochloric Acid SCHEMBL8524871 | 0.74 | CHEK2 (0.50) | TDP1HDAC1NPSR1GRIN1GRIN2B | |
| SCHEMBL15947594 | 0.74 | TDP1 (0.61) | RAD52UBE2NTDP1HDAC1GAA | |
| SCHEMBL11080274 | 0.72 | QPCT (0.58) | RAD52KDM4EMAPTMEN1TP53 | |
| SCHEMBL5031653 | 0.72 | MAPT (0.65) | ALDH1A1CBFBKDM4EMAPTTP53 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0104727-B1 | PYRIDINYL-SUBSTITUTED BENZIMIDAZOLES AND QUINOXALINES | THE UPJOHN COMPANY (US) | 1986-12-03 | — | — | EP | claimed |
| EP-0104727-A1 | Pyridinyl-substituted benzimidazoles and quinoxalines | THE UPJOHN COMPANY (US) | 1984-04-04 | — | — | EP | claimed |
| US-4430502-A | Pyridinyl substituted benzimidazoles and quinoxalines | THE UPJOHN COMPANY (US) | 1984-02-07 | — | — | US | claimed |
| EP-0104727-B1 | PYRIDINYL-SUBSTITUTED BENZIMIDAZOLES AND QUINOXALINES | THE UPJOHN COMPANY (US) | 1986-12-03 | — | — | EP | disclosed |
| EP-0104727-A1 | Pyridinyl-substituted benzimidazoles and quinoxalines | THE UPJOHN COMPANY (US) | 1984-04-04 | — | — | EP | disclosed |
| US-4430502-A | Pyridinyl substituted benzimidazoles and quinoxalines | THE UPJOHN COMPANY (US) | 1984-02-07 | — | — | US | disclosed |