Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | WDR5 | P61964 | 2/20 | 0.39 |
| ▸ | HSD17B13 | Q7Z5P4 | 2/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.39 |
| ▸ | HTR3B | O95264 | 2/20 | 0.39 |
| ▸ | HTR3A | P46098 | 2/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.39 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.39 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27578801 | 0.89 | KDM4E (0.48) | KDM4EHDAC3HDAC1RIPK1ALDH1A1 | |
| SCHEMBL27581126 | 0.84 | PTGER4 (0.51) | KDM4ERIPK1ALDH1A1HSD17B10 | |
| SCHEMBL27578696 | 0.83 | LMNA (0.41) | KDM4EALDH1A1HSD17B10NPC1RAB9A | |
| SCHEMBL10273949 | 0.81 | KDM4E (0.50) | KDM4EHDAC3HDAC1RIPK1ALDH1A1 | |
| SCHEMBL12327298 | 0.81 | KDM4E (0.44) | KDM4EHDAC3HDAC1RIPK1WDR5 | |
| SCHEMBL27581128 | 0.80 | ITGB1 (0.46) | KDM4EHDAC3HDAC1ALDH1A1TSHR | |
| SCHEMBL2433516 | 0.80 | KDM4E (0.45) | KDM4EHDAC3HDAC1RIPK1ALDH1A1 | |
| SCHEMBL14591881 | 0.79 | KDM4E (0.49) | KDM4EHDAC3HDAC1RIPK1ALDH1A1 | |
| SCHEMBL2429585 | 0.79 | KDM4E (0.46) | KDM4EHDAC3HDAC1RIPK1ALDH1A1 | |
| SCHEMBL27596547 | 0.77 | KDM4E (0.48) | KDM4EHDAC3HDAC1RIPK1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100471838-C | VLA-4 inhibitors | DAIICHI SEIYAKU CO (JP) | 2009-03-25 | — | — | CN | disclosed |
| CN-100396680-C | Vla-4 inhibitors | DAICHI PHARMACEUTICAL CO LTD (JP) | 2008-06-25 | — | — | CN | disclosed |
| CN-1699363-A | Vla-4 inhibitors | DAICHI PHARMACEUTICAL CO LTD (JP) | 2005-11-23 | — | — | CN | disclosed |
| CN-1483024-A | Vla-4 inhibitors | ��һ��������ҩ��ʽ���� | 2004-03-17 | — | — | CN | disclosed |