Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 2/20 | 0.50 |
| ▸ | MMP9 | P14780 | 2/20 | 0.50 |
| ▸ | MMP8 | P22894 | 2/20 | 0.50 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | TACR3 | P29371 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7671803 | 0.90 | RAB9A (0.50) | SHMT2ALDH1A1KDM4EHSD17B10MAPK1 | |
| SCHEMBL7677409 | 0.88 | HTR4 (0.49) | MMP2MMP9MMP8ALDH1A1KDM4E | |
| SCHEMBL7672641 | 0.83 | MMP2 (0.61) | MMP2MMP9MMP8ALDH1A1KDM4E | |
| SCHEMBL7678788 | 0.82 | POLB (0.48) | ALDH1A1KDM4EHSD17B10MAPK1L3MBTL1 | |
| SCHEMBL20267059 | 0.79 | HPGD (0.61) | ALDH1A1KDM4EHSD17B10HPGDLMNA | |
| SCHEMBL7848686 | 0.78 | MMP2 (0.69) | MMP2MMP9MMP8ALDH1A1KDM4E | |
| SCHEMBL3994050 | 0.77 | ALDH1A1 (0.56) | MMP2MMP9MMP8ALDH1A1KDM4E | |
| SCHEMBL17889139 | 0.77 | ALDH1A1 (0.50) | SHMT2ALDH1A1KDM4EHPGDLMNA | |
| SCHEMBL17889141 | 0.77 | ALDH1A1 (0.50) | SHMT2ALDH1A1KDM4EHPGDLMNA | |
| SCHEMBL7675803 | 0.76 | HTR6 (0.51) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6472418-B1 | Non-peptide NK1 receptors antagonists | WARNER-LAMBERT COMPANY | 2002-10-29 | — | — | US | disclosed |