Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 8/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | HSPB1 | P04792 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18668139 | 0.92 | S1PR4 (0.49) | S1PR4KMT2AMEN1HSPB1MAPT | |
| SCHEMBL18668176 | 0.81 | S1PR4 (0.54) | S1PR4KMT2AMEN1HSPB1MAPT | |
| SCHEMBL17186914 | 0.81 | RORC (0.52) | S1PR4KMT2AMEN1HSPB1MAPT | |
| SCHEMBL17186841 | 0.80 | HSPB1 (0.48) | S1PR4KMT2AMEN1HSPB1MAPT | |
| SCHEMBL17186736 | 0.80 | RORC (0.48) | S1PR4KMT2AMEN1HSPB1MAPT | |
| SCHEMBL18668216 | 0.80 | S1PR4 (0.33) | S1PR4POLBCYP3A4KDM4E | |
| SCHEMBL18668208 | 0.80 | S1PR4 (0.47) | S1PR4KMT2AMEN1HSPB1MAPT | |
| SCHEMBL18668183 | 0.79 | S1PR4 (0.46) | S1PR4KMT2AMEN1HSPB1MAPT | |
| SCHEMBL18668160 | 0.78 | S1PR4 (0.48) | S1PR4KMT2AMEN1HSPB1MAPT | |
| SCHEMBL18668144 | 0.77 | KMT2A (0.45) | S1PR4KMT2AMEN1HSPB1MAPT |
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-2017051319-A1 | ARYL AND HETEROARYL ETHER COMPOUNDS AS ROR GAMMA MODULATORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2017-03-30 | — | — | WO | disclosed |