Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.50 |
| ▸ | RAB9A | P51151 | 7/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | GRM4 | Q14833 | 5/20 | 0.50 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | PKM | P14618 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | GRM5 | P41594 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1661528 | 0.76 | KDM4E (0.46) | KDM4ERAB9AALDH1A1GRM4NPC1 | |
| SCHEMBL1661513 | 0.76 | GRM4 (0.46) | KDM4ERAB9AALDH1A1GRM4NPC1 | |
| SCHEMBL9256292 | 0.75 | CCR1 (0.41) | KDM4ERAB9AALDH1A1NPC1MEN1 | |
| SCHEMBL31003229 | 0.75 | CCR1 (0.41) | KDM4ERAB9AALDH1A1NPC1MEN1 | |
| SCHEMBL1661557 | 0.75 | NPC1 (0.43) | KDM4ERAB9AALDH1A1GRM4NPC1 | |
| SCHEMBL9169404 | 0.72 | KDM4E (0.70) | KDM4ERAB9AALDH1A1GRM4NPC1 | |
| SCHEMBL29021923 | 0.70 | KDM4E (0.72) | KDM4ERAB9AALDH1A1GRM4NPC1 | |
| SCHEMBL6312457 | 0.68 | GRM5 (0.69) | KDM4ERAB9AALDH1A1GRM4NPC1 | |
| SCHEMBL6312461 | 0.68 | GRM5 (0.69) | KDM4ERAB9AALDH1A1GRM4NPC1 | |
| SCHEMBL805088 | 0.68 | SMN1; SMN2 (0.42) | KDM4ERAB9AALDH1A1NPC1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2306994-A1 | S1P1 RECEPTOR AGONISTS AND USE THEREOF | Amgen, Inc (US) | 2011-04-13 | — | — | EP | disclosed |
| WO-2009154775-A1 | S1P1 RECEPTOR AGONISTS AND USE THEREOF | AMGEN INC. (US) | 2009-12-23 | — | — | WO | disclosed |