Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | JMJD6 | Q6NYC1 | 6/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12520710 | 0.82 | SMN1; SMN2 (0.41) | TSHRJMJD6KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL17187792 | 0.82 | MKNK1 (0.38) | TSHRJMJD6KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL25117691 | 0.76 | KMT2A (0.35) | TSHRJMJD6KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL19555419 | 0.76 | HTT (0.50) | TSHRJMJD6KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL19029839 | 0.76 | RAF1 (0.33) | ALDH1A1 | |
| SCHEMBL19030109 | 0.76 | ALDH1A1 (0.51) | TSHRJMJD6KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL28562776 | 0.73 | JMJD6 (0.37) | JMJD6SMN1; SMN2KDM4EALDH1A1LMNA | |
| SCHEMBL10586306 | 0.73 | ALDH1A1 (0.40) | TSHRKMT2ASMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL19029975 | 0.72 | — | — | |
| SCHEMBL1357421 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | claimed |