Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 5/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL315428 | 0.99 | GHSR (0.56) | GHSRKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL316059 | 0.94 | KMT2A (0.59) | GHSRKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL316051 | 0.93 | KMT2A (0.67) | GHSRKMT2AMEN1ALDH1A1GAA | |
| SCHEMBL315461 | 0.92 | KMT2A (0.65) | GHSRKMT2AMEN1ALDH1A1GAA | |
| SCHEMBL316159 | 0.85 | KMT2A (0.58) | GHSRKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL314979 | 0.84 | GHSR (0.62) | GHSRKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL1514721 | 0.81 | KMT2A (0.70) | GHSRKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL315998 | 0.81 | KMT2A (0.57) | GHSRKMT2AMEN1ALDH1A1GAA | |
| SCHEMBL316299 | 0.79 | KMT2A (0.57) | GHSRKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL316050 | 0.79 | GHSR (0.61) | GHSRKMT2AMEN1ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-8093272-B2 | Heteroaryl substituted cyclohexyl-1,4-diamine compounds | GRUENENTHAL GMBH (DE) | 2012-01-10 | — | — | US | claimed |
| US-8093272-B2 | Heteroaryl substituted cyclohexyl-1,4-diamine compounds | GRUENENTHAL GMBH (DE) | 2012-01-10 | — | — | US | disclosed |