Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SLC6A19 | Q695T7 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6204838 | 0.83 | ALDH1A1 (0.47) | ALDH1A1SLC6A19HSD11B1MAPTPOLB | |
| SCHEMBL27696264 | 0.83 | SLC6A19 (0.50) | ALDH1A1HPGDSLC6A19HSD11B1MAPT | |
| SCHEMBL16618643 | 0.81 | ALDH1A1 (0.61) | ALDH1A1SLC6A19HSD11B1MAPTPOLB | |
| SCHEMBL18243744 | 0.77 | ALDH1A1 (0.57) | ALDH1A1SLC6A19HSD11B1MAPTPOLB | |
| SCHEMBL1230594 | 0.77 | RELA (0.44) | ALDH1A1KDM4EMAOAMAOBCYP1A2 | |
| SCHEMBL6204519 | 0.75 | ALDH1A1 (0.42) | ALDH1A1HPGDSLC6A19HSD11B1MAPT | |
| SCHEMBL28769190 | 0.72 | ALDH1A1 (0.61) | ALDH1A1SLC6A19HSD11B1MAPTPOLB | |
| SCHEMBL9305792 | 0.71 | CYP1A2 (0.55) | ALDH1A1SLC6A19HSD11B1MAPTPOLB | |
| SCHEMBL2793141 | 0.71 | ALDH1A1 (0.43) | ALDH1A1HPGDMAPTPOLBKDM4E | |
| SCHEMBL2793139 | 0.71 | ALDH1A1 (0.43) | ALDH1A1HPGDMAPTPOLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-105555766-A | Aminomethyl-biaryl derivatives as complement factor D inhibitors and uses thereof | NOVARTIS AG | 2016-05-04 | — | — | CN | disclosed |