Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | NPC1 | O15118 | 5/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.52 |
| ▸ | HPGD | P15428 | 5/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | KIFC1 | Q9BW19 | 1/20 | 0.49 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.46 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 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 | |
|---|---|---|---|---|
| SCHEMBL6088535 | 0.87 | ALDH1A1 (0.54) | ALDH1A1NPC1NPSR1RXFP1SMN1; SMN2 | |
| SCHEMBL6086986 | 0.84 | ALDH1A1 (0.55) | ALDH1A1NPC1NPSR1RXFP1SMN1; SMN2 | |
| SCHEMBL6086619 | 0.84 | ALDH1A1 (0.67) | ALDH1A1NPC1NPSR1RXFP1SMN1; SMN2 | |
| SCHEMBL6087860 | 0.82 | SMN1; SMN2 (0.66) | ALDH1A1NPC1NPSR1RXFP1SMN1; SMN2 | |
| SCHEMBL6087709 | 0.82 | SMN1; SMN2 (0.48) | ALDH1A1NPC1NPSR1RXFP1SMN1; SMN2 | |
| SCHEMBL6087659 | 0.81 | ALDH1A1 (0.58) | ALDH1A1NPC1NPSR1RXFP1SMN1; SMN2 | |
| SCHEMBL6089260 | 0.79 | ALDH1A1 (0.60) | ALDH1A1NPC1NPSR1RXFP1SMN1; SMN2 | |
| SCHEMBL6091201 | 0.78 | ALDH1A1 (0.59) | ALDH1A1NPC1NPSR1RXFP1SMN1; SMN2 | |
| SCHEMBL6088091 | 0.75 | SMN1; SMN2 (0.56) | ALDH1A1NPC1NPSR1RXFP1SMN1; SMN2 | |
| SCHEMBL6087541 | 0.75 | ALDH1A1 (0.52) | ALDH1A1NPC1NPSR1RXFP1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7109224-B2 | Acyl guanidine compounds and use thereof | BRISTOL-MYERS SQUIBB CO. (US) | 2006-09-19 | — | — | US | disclosed |