Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | CFTR | P13569 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.43 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29424088 | 1.00 | ALDH1A1 (0.55) | ALDH1A1HSD17B10CFTRLMNAKDM4E | |
| SCHEMBL15528607 | 0.89 | ALDH1A1 (0.55) | ALDH1A1HSD17B10CFTRLMNAKDM4E | |
| SCHEMBL1035344 | 0.88 | ALDH1A1 (0.53) | ALDH1A1HSD17B10CFTRLMNAKDM4E | |
| SCHEMBL15845989 | 0.86 | ALDH1A1 (0.51) | ALDH1A1HSD17B10CFTRLMNAKDM4E | |
| SCHEMBL3676590 | 0.85 | LMNA (0.55) | ALDH1A1HSD17B10CFTRLMNAKDM4E | |
| SCHEMBL28280190 | 0.85 | ALDH1A1 (0.50) | ALDH1A1HSD17B10CFTRLMNAKDM4E | |
| Hydrochloric Acid SCHEMBL6475587 | 0.85 | ALDH1A1 (0.50) | ALDH1A1HSD17B10CFTRLMNAKDM4E | |
| SCHEMBL2895994 | 0.85 | ALDH1A1 (0.67) | ALDH1A1HSD17B10CFTRLMNAKDM4E | |
| SCHEMBL29266193 | 0.82 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CFTRLMNAKDM4E | |
| SCHEMBL28281237 | 0.82 | ALDH1A1 (0.48) | ALDH1A1HSD17B10CFTRLMNAKDM4E |
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-0450179-A1 | Polyurethane ureas having diaminoanthraquinones as chain extending agents and process for the preparation of the polyurethane ureas | BAYER AG (DE) | 1991-10-09 | — | — | EP | disclosed |