Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.56 |
| ▸ | MEN1 | O00255 | 4/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | GHSR | Q92847 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL316050 | 0.95 | GHSR (0.61) | KMT2AMEN1NPC1GHSRALDH1A1 | |
| SCHEMBL316299 | 0.92 | KMT2A (0.57) | KMT2AMEN1NPC1GHSRSMN1; SMN2 | |
| SCHEMBL316641 | 0.89 | KMT2A (0.65) | KMT2AMEN1GHSRALDH1A1MAPT | |
| SCHEMBL316102 | 0.87 | GHSR (0.56) | KMT2AMEN1NPC1GHSRSMN1; SMN2 | |
| SCHEMBL314979 | 0.86 | GHSR (0.62) | KMT2AMEN1GHSRPOLBALDH1A1 | |
| SCHEMBL316457 | 0.86 | GHSR (0.54) | KMT2AMEN1NPC1GHSRSMN1; SMN2 | |
| SCHEMBL316534 | 0.86 | KMT2A (0.58) | KMT2AMEN1NPC1GHSRSMN1; SMN2 | |
| SCHEMBL316345 | 0.86 | KMT2A (0.61) | KMT2AMEN1NPC1GHSRSMN1; SMN2 | |
| SCHEMBL315817 | 0.86 | GHSR (0.56) | KMT2AMEN1NPC1GHSRSMN1; SMN2 | |
| SCHEMBL316040 | 0.85 | GHSR (0.55) | KMT2AMEN1NPC1GHSRSMN1; SMN2 |
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 |