Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | POLB | P06746 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | F12 | P00748 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19452132 | 0.88 | ALDH1A1 (0.51) | ALDH1A1POLBKDM4EHPGDRAB9A | |
| SCHEMBL20353019 | 0.86 | ALDH1A1 (0.64) | ALDH1A1POLBKDM4EHPGDRAB9A | |
| SCHEMBL18356836 | 0.86 | ALDH1A1 (0.64) | ALDH1A1POLBKDM4EHPGDRAB9A | |
| SCHEMBL19368286 | 0.86 | ALDH1A1 (0.64) | ALDH1A1POLBKDM4EHPGDRAB9A | |
| SCHEMBL20353021 | 0.86 | ALDH1A1 (0.64) | ALDH1A1POLBKDM4EHPGDRAB9A | |
| SCHEMBL23511774 | 0.86 | ALDH1A1 (0.64) | ALDH1A1POLBKDM4EHPGDRAB9A | |
| SCHEMBL19452135 | 0.85 | CRHR1 (0.40) | ALDH1A1POLBKDM4EHPGDRAB9A | |
| SCHEMBL21460966 | 0.85 | CRHR1 (0.40) | ALDH1A1POLBKDM4EHPGDRAB9A | |
| SCHEMBL19452131 | 0.83 | ALDH1A1 (0.40) | ALDH1A1POLBKDM4EHPGDRAB9A | |
| SCHEMBL21757540 | 0.83 | ALDH1A1 (0.55) | ALDH1A1POLBKDM4EHPGDRAB9A |
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-2017176962-A1 | PYRROLO[1,2-A]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS | LYSOSOMAL THERAPEUTICS, INC. (US) | 2017-10-12 | — | — | WO | disclosed |