Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 4/20 | 0.74 |
| ▸ | NPC1 | O15118 | 5/20 | 0.69 |
| ▸ | RAB9A | P51151 | 5/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.67 |
| ▸ | MITF | O75030 | 1/20 | 0.67 |
| ▸ | XBP1 | P17861 | 1/20 | 0.67 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.67 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.66 |
| ▸ | TRPV1 | Q8NER1 | 9/20 | 0.64 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.59 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.59 |
| ▸ | RELA | Q04206 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL845978 | 0.86 | KDR (0.79) | KDRNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL995474 | 0.85 | KDR (1.00) | KDRNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL846420 | 0.84 | KDR (0.75) | KDRNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL19616459 | 0.82 | KDR (0.81) | KDRNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL846685 | 0.82 | KDR (0.81) | KDRNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL29647749 | 0.82 | KDR (0.81) | KDRNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL13991514 | 0.81 | NPC1 (0.76) | KDRNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL846078 | 0.81 | KDR (0.71) | KDRNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL846075 | 0.81 | NPC1 (0.71) | KDRNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL845883 | 0.81 | KDR (0.66) | KDRNPC1RAB9AALDH1A1KDM4E |
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-3193611-A2 | MK2 INHIBITORS AND USES THEREOF | CELGENE CAR LLC (BM) | 2017-07-26 | — | — | EP | disclosed |
| WO-2016044463-A2 | MK2 INHIBITORS AND USES THEREOF | CELGENE AVILOMICS RESEARCH, INC. (US) | 2016-03-24 | — | — | WO | disclosed |