Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL21076846 | 0.86 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL21076793 | 0.83 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2RAB9ANPC1TP53 | |
| SCHEMBL6878797 | 0.75 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2RAB9ANPC1TP53 | |
| SCHEMBL21077035 | 0.74 | CTPS1 (0.52) | ALDH1A1SMN1; SMN2TP53HPGDMAPT | |
| SCHEMBL21077075 | 0.74 | CTPS1 (0.64) | SMN1; SMN2TP53MAPTMEN1KMT2A | |
| SCHEMBL21044575 | 0.73 | CTPS1 (0.60) | ALDH1A1SMN1; SMN2RAB9ANPC1TP53 | |
| SCHEMBL4968797 | 0.73 | SMN1; SMN2 (0.65) | ALDH1A1SMN1; SMN2RAB9ANPC1TP53 | |
| SCHEMBL21044371 | 0.72 | CTPS1 (0.55) | ALDH1A1SMN1; SMN2RAB9ANPC1TP53 | |
| SCHEMBL10134063 | 0.72 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2RAB9ANPC1TP53 | |
| SCHEMBL11934883 | 0.71 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2RAB9ANPC1TP53 |
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-3492454-A1 | COMPOUNDS | Step Pharma S.A.S. (FR) | 2019-06-05 | — | — | EP | disclosed |