Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | LSS | P48449 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | PKM | P14618 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.34 |
| ▸ | CA2 | P00918 | 4/20 | 0.34 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL17899692 | 0.86 | PKM (0.46) | LMNAHPGDALDH1A1PKMSMN1; SMN2 | |
| SCHEMBL17899665 | 0.86 | KMT2A (0.44) | LMNAMAPTALDH1A1GAA | |
| SCHEMBL17899699 | 0.86 | KMT2A (0.39) | PKMSMN1; SMN2GAATDP1 | |
| SCHEMBL17899697 | 0.85 | LMNA (0.43) | LMNAMAPTHPGDRECQLALDH1A1 | |
| SCHEMBL17899652 | 0.83 | ALDH1A1 (0.43) | LMNAMAPTHPGDALDH1A1PKM | |
| SCHEMBL17899694 | 0.83 | PKM (0.48) | ALDH1A1PKMSMN1; SMN2GAAHTT | |
| SCHEMBL17899650 | 0.83 | KMT2A (0.46) | LMNAMAPTALDH1A1GAA | |
| SCHEMBL17899649 | 0.83 | KMT2A (0.41) | MAPTPKMSMN1; SMN2GAATDP1 | |
| SCHEMBL17897332 | 0.83 | EPHX2 (0.41) | ALDH1A1CA1CA2CA12CA9 | |
| SCHEMBL17899695 | 0.83 | ALDH1A1 (0.43) | LMNAHPGDALDH1A1PKMSMN1; SMN2 |
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-2016107544-A1 | INTERMEDIATE COMPOUND FOR PREPARING PYRROLE AMIDE COMPOUND AND PREPARATION METHOD AND USE THEREOF | 成都先导药物开发有限公司 | 2016-07-07 | — | — | WO | disclosed |