Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | SRD5A2 | P31213 | 6/20 | 0.44 |
| ▸ | SRD5A1 | P18405 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA4 | P22748 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | CA6 | P23280 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27356467 | 0.98 | ALDH1A1 (0.48) | ALDH1A1SRD5A2SRD5A1TSHRTP53 | |
| Hydrochloric Acid SCHEMBL27447092 | 0.98 | ALDH1A1 (0.48) | ALDH1A1SRD5A2SRD5A1TSHRTP53 | |
| Trifluoroacetic Acid SCHEMBL27357823 | 0.90 | ALDH1A1 (0.42) | ALDH1A1SRD5A2SRD5A1TSHRTP53 | |
| SCHEMBL29599491 | 0.87 | ALDH1A1 (0.46) | ALDH1A1SRD5A2SRD5A1TSHRTP53 | |
| SCHEMBL484995 | 0.86 | ALDH1A1 (0.48) | ALDH1A1SRD5A2SRD5A1TSHRTP53 | |
| SCHEMBL30809642 | 0.86 | ALDH1A1 (0.48) | ALDH1A1SRD5A2SRD5A1TSHRTP53 | |
| Hydrochloric Acid SCHEMBL29600401 | 0.85 | ALDH1A1 (0.44) | ALDH1A1SRD5A2SRD5A1TSHRTP53 | |
| Hydrochloric Acid SCHEMBL27838744 | 0.85 | ALDH1A1 (0.47) | ALDH1A1SRD5A2SRD5A1TSHRTP53 | |
| Hydrochloric Acid SCHEMBL3142402 | 0.83 | MAPT (0.50) | ALDH1A1KDM4EMAPTPOLBL3MBTL1 | |
| SCHEMBL14124811 | 0.82 | CDC25B (0.57) | ALDH1A1KDM4ECA1CA2CA9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008071766-A2 | SPIRO-INDENE SUBSTITUTED IMIDAZONAPHYTHYRIDINE AND PYRANOIMIDAZOPYRIDINE DERIVATIVES AS INHIBITORS OF GASTRIC ACID SECRETION | NYCOMED GMBH (DE) | 2008-06-19 | — | — | WO | claimed |
| CN-1051547-C | Beta-lactams derivative and its prep. and use | HOFFMANN LA ROCHE (CH) | 2000-04-19 | — | — | CN | claimed |
| CN-1132752-A | Beta-lactam derivatives, process for their preparation and their use | HOFFMANN LA ROCHE (CH) | 1996-10-09 | — | — | CN | claimed |
| CN-1051547-C | Beta-lactams derivative and its prep. and use | HOFFMANN LA ROCHE (CH) | 2000-04-19 | — | — | CN | disclosed |
| CN-1132752-A | Beta-lactam derivatives, process for their preparation and their use | HOFFMANN LA ROCHE (CH) | 1996-10-09 | — | — | CN | disclosed |