Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.50 |
| ▸ | TERT | O14746 | 2/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | BBOX1 | O75936 | 2/20 | 0.46 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.46 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CCKAR | P32238 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18332893 | 1.00 | KDM4E (0.55) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL31099235 | 0.88 | SELL (0.50) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL18196593 | 0.85 | GPR139 (0.50) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL18285162 | 0.83 | CA2 (0.49) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL27536297 | 0.83 | CA2 (0.49) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL6809242 | 0.83 | CA2 (0.49) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL6809240 | 0.83 | CA2 (0.49) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL11111255 | 0.82 | ALDH1A1 (0.56) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL11111257 | 0.82 | ALDH1A1 (0.56) | KDM4EALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL8897190 | 0.81 | CA2 (0.52) | ALDH1A1CA2CA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6380181-B1 | AMINO ACID RESIDUES IN THE 3-AND/OR 4-POSITION FUNCTION AS SIDEROPHORES AND/OR AS BIOLOGICAL CHELATING AGENTS FOR IRON IN GRAM-NEGATIVE BACTERIA | GRUENENTHAL GMBH (DE) | 2002-04-30 | — | — | US | disclosed |
| EP-0907633-B1 | NEW SYNTHETIC CATECHOL DERIVATIVES, METHOD FOR PRODUCTION AND USE THEREOF | GRUENENTHAL GMBH (DE) | 2001-08-22 | — | — | EP | disclosed |
| EP-0907633-A1 | NEW SYNTHETIC CATECHOL DERIVATIVES, METHOD FOR PRODUCTION AND USE THEREOF | Grünenthal GmbH (DE) | 1999-04-14 | — | — | EP | disclosed |
| WO-1997049670-A1 | NEW SYNTHETIC CATECHOL DERIVATIVES, METHOD FOR PRODUCTION AND USE THEREOF | Grünenthal GmbH (DE) | 1997-12-31 | — | — | WO | disclosed |