Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 6/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 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 | |
|---|---|---|---|---|
| SCHEMBL18154488 | 0.78 | ALDH1A1 (0.45) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL19105293 | 0.74 | ALDH1A1 (0.48) | ALDH1A1ATMHCAR2POLBHPGD | |
| SCHEMBL196154 | 0.72 | ALDH1A1 (0.54) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL19105305 | 0.71 | ALDH1A1 (0.48) | ALDH1A1ATMHCAR2POLBHPGD | |
| SCHEMBL27861178 | 0.70 | ALDH1A1 (0.44) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL16160733 | 0.70 | ALDH1A1 (0.52) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL28289556 | 0.70 | ALDH1A1 (0.52) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL19105204 | 0.70 | ALDH1A1 (0.52) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL9937877 | 0.70 | ALDH1A1 (0.52) | ALDH1A1ATMHCAR2HPGDTSHR | |
| Ammonia Solution, Strong SCHEMBL27601992 | 0.70 | ALDH1A1 (0.52) | ALDH1A1ATMHCAR2HPGDTSHR |
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-2016140878-A9 | PRODRUGS RILUZOLE AND THEIR METHOD OF USE | BIOHAVEN PHARMACEUTICAL HOLDING COMPANY LTD. (US) | 2016-10-20 | — | — | WO | disclosed |