Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GMNN | O75496 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CETP | P11597 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | UBE2N | P61088 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28428932 | 0.98 | SPHK1 (0.45) | SPHK1CYP2D6LMNAGMNNPOLB | |
| Hydrochloric Acid SCHEMBL28454706 | 0.98 | SPHK1 (0.45) | SPHK1CYP2D6LMNAGMNNPOLB | |
| SCHEMBL117121 | 0.94 | SPHK1 (0.45) | SPHK1CYP2D6LMNAGMNNPOLB | |
| SCHEMBL7566212 | 0.91 | ALDH1A1 (0.39) | SPHK1CYP2D6LMNAGMNNPOLB | |
| SCHEMBL27382506 | 0.85 | GPR84 (0.41) | SPHK1CYP2D6LMNAGMNNPOLB | |
| SCHEMBL22714170 | 0.84 | SPHK1 (0.46) | SPHK1CYP2D6LMNAGMNNPOLB | |
| SCHEMBL5692575 | 0.81 | TSHR (0.47) | SPHK1LMNAMAPTGPR84FFAR1 | |
| SCHEMBL13851797 | 0.81 | TSHR (0.47) | SPHK1LMNAMAPTGPR84FFAR1 | |
| SCHEMBL11681882 | 0.81 | TSHR (0.47) | SPHK1LMNAMAPTGPR84FFAR1 | |
| SCHEMBL20054095 | 0.81 | TSHR (0.47) | SPHK1LMNAMAPTGPR84FFAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0013072-B1 | LONG CHAIN AMINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-04-13 | — | — | EP | disclosed |