Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.42 |
| ▸ | FDPS | P14324 | 10/20 | 0.39 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CETP | P11597 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | UBE2N | P61088 | 1/20 | 0.39 |
| ▸ | GGPS1 | O95749 | 6/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11761134 | 1.00 | SPHK1 (0.42) | SPHK1FDPSSMPD1CYP2D6GMNN | |
| SCHEMBL7680803 | 0.82 | GGPS1 (0.40) | FDPSSMPD1GGPS1 | |
| SCHEMBL8953030 | 0.81 | FDPS (0.38) | SPHK1FDPSSMPD1CYP2D6GMNN | |
| SCHEMBL11761124 | 0.77 | FDPS (0.39) | SPHK1FDPSSMPD1CYP2D6GMNN | |
| SCHEMBL6949109 | 0.77 | GGPS1 (0.43) | FDPSSMPD1GGPS1 | |
| SCHEMBL7048982 | 0.76 | SPHK1 (0.43) | SPHK1FDPSSMPD1CYP2D6GMNN | |
| SCHEMBL11219203 | 0.76 | SPHK1 (0.43) | SPHK1FDPSSMPD1CYP2D6GMNN | |
| SCHEMBL669681 | 0.75 | TSHR (0.32) | — | |
| Water SCHEMBL7545961 | 0.75 | DNM1 (0.38) | SPHK1FDPSSMPD1 | |
| SCHEMBL638853 | 0.75 | OPRM1 (0.44) | SPHK1FDPSSMPD1GGPS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008059014-A2 | ANTITUBERCULOSIS AGENTS WITH ALKYLIDENE OR ALKYL SIDE CHAIN | UNIVERSIDAD DE SALAMANCA (ES) | 2008-05-22 | — | — | WO | disclosed |