Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 10/20 | 0.45 |
| ▸ | CA1 | P00915 | 7/20 | 0.45 |
| ▸ | CA12 | O43570 | 6/20 | 0.45 |
| ▸ | CA9 | Q16790 | 6/20 | 0.45 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | DOT1L | Q8TEK3 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9036467 | 0.79 | KMT2A (0.53) | CA2CA1CA12CA9VCAM1 | |
| SCHEMBL3668017 | 0.70 | CCR6 (0.36) | ALDH1A1TDP1HPGDMAPTPOLB | |
| SCHEMBL8123057 | 0.68 | ALDH1A1 (0.40) | ALDH1A1TDP1HPGDMAPTPOLB | |
| SCHEMBL8123110 | 0.68 | GRIN2D (0.33) | ALDH1A1HPGDMAPT | |
| SCHEMBL8127087 | 0.68 | CAPN9 (0.31) | HPGDMAPT | |
| SCHEMBL3674251 | 0.68 | TSHR (0.38) | ALDH1A1TDP1POLBKDM4E | |
| SCHEMBL8122907 | 0.68 | TSHR (0.35) | VCAM1ALDH1A1TDP1HPGDMAPT | |
| SCHEMBL8128520 | 0.68 | CAPN9 (0.31) | HPGDMAPT | |
| SCHEMBL3682051 | 0.68 | MAPT (0.62) | CA2CA1CA12CA9VCAM1 | |
| SCHEMBL3668151 | 0.67 | GPR35 (0.42) | ALDH1A1TDP1HPGDMAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0696289-A1 | BENZO F]QUINOXALINDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN DRUGS | SCHERING AG (DE) | 1996-02-14 | — | — | EP | disclosed |