Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CPA1 | P15085 | 1/20 | 0.48 |
| ▸ | CPA2 | P48052 | 1/20 | 0.48 |
| ▸ | CPA4 | Q9UI42 | 1/20 | 0.48 |
| ▸ | CTRB1 | P17538 | 5/20 | 0.48 |
| ▸ | CTSG | P08311 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7619607 | 0.87 | ACACB (0.57) | — | |
| SCHEMBL4607184 | 0.86 | CNR2 (0.51) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL23201144 | 0.86 | CNR2 (0.51) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL3066768 | 0.86 | CNR2 (0.51) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL10792660 | 0.84 | MTNR1A (0.51) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL2089507 | 0.83 | MAPK1 (0.69) | KMT2ACYP3A4MAPK1CTRB1NPC1 | |
| SCHEMBL6319150 | 0.83 | MAPK1 (0.69) | KMT2ACYP3A4MAPK1CTRB1NPC1 | |
| SCHEMBL6529461 | 0.83 | MAPK1 (0.69) | KMT2ACYP3A4MAPK1CTRB1NPC1 | |
| SCHEMBL21496788 | 0.83 | SMN1; SMN2 (0.50) | SMN1; SMN2KMT2AMEN1HTTHPGD | |
| SCHEMBL21496785 | 0.83 | SMN1; SMN2 (0.50) | SMN1; SMN2KMT2AMEN1HTTHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9133096-B2 | Process for the production of 2-amino-2[2-(4-C2-20-alkyl-phenyl)ethyl]propane-1,3-diols, and to compounds for use therein | NOVARTIS AG (CH) | 2015-09-15 | — | — | US | disclosed |
| EP-2268603-B1 | PROCESS FOR THE PREPARATION OF 2-AMINO-2- [2- (4-C3-C21-ALKYL-PHENYL)ETHYL]PROPANE-1, 3-DIOLS | NOVARTIS AG (CH) | 2015-04-22 | — | — | EP | disclosed |
| US-8809571-B2 | Process for the production of 2-amino-2-[2-(4-C2-20-alkyl-phenyl)ethyl]propane-1,3-diols, and to compounds for use therein | NOVARTIS AG (CH) | 2014-08-19 | — | — | US | disclosed |