Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 10/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 9/20 | 0.45 |
| ▸ | MAPK12 | P53778 | 9/20 | 0.45 |
| ▸ | MAPK11 | Q15759 | 9/20 | 0.45 |
| ▸ | RAF1 | P04049 | 2/20 | 0.45 |
| ▸ | GCGR | P47871 | 7/20 | 0.45 |
| ▸ | CBFB | Q13951 | 4/20 | 0.43 |
| ▸ | METAP2 | P50579 | 3/20 | 0.43 |
| ▸ | METAP1 | P53582 | 3/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CCR1 | P32246 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.40 |
| ▸ | CCR8 | P51685 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TEK | Q02763 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8476402 | 0.91 | MAPK13 (0.47) | MAPK14MAPK13MAPK12MAPK11RAF1 | |
| SCHEMBL8480171 | 0.88 | TGFBR1 (0.48) | MAPK14MAPK13MAPK12MAPK11GCGR | |
| SCHEMBL8481652 | 0.85 | MAPK13 (0.43) | MAPK14MAPK13MAPK12MAPK11RAF1 | |
| SCHEMBL8480021 | 0.85 | MAPK13 (0.44) | MAPK14MAPK13MAPK12MAPK11RAF1 | |
| SCHEMBL8479495 | 0.85 | MAPK14 (0.49) | MAPK14CBFBMETAP2METAP1GRM5 | |
| SCHEMBL8478420 | 0.82 | MAPK14 (0.39) | MAPK14MAPK13MAPK12MAPK11RAF1 | |
| SCHEMBL5184500 | 0.81 | MAPK14 (0.68) | MAPK14MAPK13MAPK12MAPK11RAF1 | |
| SCHEMBL8481639 | 0.81 | MAPK13 (0.44) | MAPK14MAPK13MAPK12MAPK11RAF1 | |
| SCHEMBL8482422 | 0.78 | MAPT (0.42) | MAPK14MAPK13MAPK12MAPK11RAF1 | |
| SCHEMBL5623031 | 0.76 | KDM4E (0.57) | MAPK14MAPK13MAPK12MAPK11RAF1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5959113-A | REACTING A DIKETONE DERIVATIVE WITH AN ALDEHYDE DERIVATIVE; ADMINISTERING TO TREAT ATHEROSCLEROSIS, PSORIASIS, ALOPECIA AND TUMORS | HOFFMANN-LA ROCHE INC. (US) | 1999-09-28 | — | — | US | claimed |
| US-5959113-A | REACTING A DIKETONE DERIVATIVE WITH AN ALDEHYDE DERIVATIVE; ADMINISTERING TO TREAT ATHEROSCLEROSIS, PSORIASIS, ALOPECIA AND TUMORS | HOFFMANN-LA ROCHE INC. (US) | 1999-09-28 | — | — | US | disclosed |