Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 6/20 | 0.40 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.35 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CETP | P11597 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | UBE2N | P61088 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | GGPS1 | O95749 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28068709 | 0.91 | FDPS (0.44) | FDPSSPHK1SMPD1CYP2D6GMNN | |
| SCHEMBL28229869 | 0.85 | — | — | |
| SCHEMBL27924094 | 0.81 | FDPS (0.40) | FDPSSPHK1SMPD1TP53OPRM1 | |
| SCHEMBL11172593 | 0.77 | FDPS (0.38) | FDPSSPHK1SMPD1CYP2D6GMNN | |
| SCHEMBL8953030 | 0.75 | FDPS (0.38) | FDPSSPHK1SMPD1CYP2D6GMNN | |
| SCHEMBL2138289 | 0.74 | FDPS (0.42) | FDPSSMPD1DPP7SLC15A1 | |
| SCHEMBL2510404 | 0.74 | — | — | |
| SCHEMBL5885255 | 0.73 | SPHK1 (0.37) | FDPSSPHK1CYP2D6GMNNLMNA | |
| SCHEMBL11328501 | 0.73 | FDPS (0.38) | FDPSSPHK1SMPD1TP53OPRM1 | |
| Bromide SCHEMBL28556012 | 0.73 | FDPS (0.41) | FDPSSMPD1DPP7SLC15A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103265677-B | The manufacture method of hydroxy alkyl triethylenediamine compounds and use its polyurethane resin catalyst for producing compositions | 东曹株式会社 | 2016-06-08 | — | — | CN | disclosed |