Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.31 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.31 |
| ▸ | HSF1 | Q00613 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5202337 | 0.83 | KDM4E (0.36) | TSHRKDM4EALDH1A1GAANPSR1 | |
| SCHEMBL3559045 | 0.70 | ALDH1A1 (0.41) | TSHRKDM4EALDH1A1ABL1RIN1 | |
| SCHEMBL5199693 | 0.67 | MAPT (0.34) | TSHRKDM4EALDH1A1HSD17B10PKM | |
| SCHEMBL11826761 | 0.65 | ALDH1A1 (0.57) | KDM4EALDH1A1HPGDMAPTKMT2A | |
| SCHEMBL5204329 | 0.64 | KDM4E (0.39) | KDM4EALDH1A1SYKHCRTR1HCRTR2 | |
| SCHEMBL3507805 | 0.64 | ALDH1A1 (0.54) | KDM4EALDH1A1KMT2A | |
| SCHEMBL8537268 | 0.63 | SYK (0.51) | KDM4EALDH1A1HSD17B10MAPTSYK | |
| SCHEMBL5200407 | 0.63 | KDM4E (0.41) | KDM4EALDH1A1 | |
| SCHEMBL3591993 | 0.63 | MAPT (0.52) | KDM4EALDH1A1L3MBTL1HSD17B10MAPT | |
| SCHEMBL5200333 | 0.62 | KDM4E (0.39) | KDM4EALDH1A1MAPTHCRTR1HCRTR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1817030-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | Kalypsys, Inc. (US) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006060424-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | KALYPSYS, INC. (US) | 2006-06-08 | — | — | WO | disclosed |