Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.49 |
| ▸ | QPCT | Q16769 | 2/20 | 0.48 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 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 | |
|---|---|---|---|---|
| SCHEMBL11080274 | 0.88 | QPCT (0.58) | HRH4HRH3QPCTQPCTLCYP11B1 | |
| SCHEMBL28195437 | 0.78 | QPCTL (0.46) | QPCTLCYP11B1CYP11B2CYP3A4NTRK1 | |
| SCHEMBL6962240 | 0.74 | QPCT (0.77) | QPCTQPCTLCYP11B1CYP11B2MEN1 | |
| SCHEMBL5305972 | 0.73 | L3MBTL1 (0.57) | TSHRCYP3A4BLMNAMPT | |
| SCHEMBL727185 | 0.73 | CYP1A2 (0.62) | HRH4HRH3CYP11B1CYP11B2TBXAS1 | |
| SCHEMBL10918546 | 0.72 | CACNA1H (0.43) | GABRA1GABRB2TBXAS1TSHRMEN1 | |
| SCHEMBL10919292 | 0.71 | TBXAS1 (0.43) | GABRA1GABRB2TBXAS1TSHRMEN1 | |
| SCHEMBL14257669 | 0.71 | CYP1A2 (0.56) | HRH4HRH3CYP11B1CYP11B2TBXAS1 | |
| SCHEMBL23366491 | 0.71 | MAPT (0.42) | QPCTCYP3A4BLMNAMPT | |
| SCHEMBL2022694 | 0.71 | MAPT (0.42) | QPCTCYP3A4BLMNAMPT |
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 |
|---|---|---|---|---|---|---|---|
| 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 |