Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12386648 | 0.80 | ALDH1A1 (0.43) | ALDH1A1TDP1TSHRLMNAPRSS1 | |
| SCHEMBL14403319 | 0.77 | TP53 (0.52) | ALDH1A1TDP1MAPT | |
| SCHEMBL19522683 | 0.77 | ACHE (0.39) | ALDH1A1TSHRLMNAACHEMEN1 | |
| SCHEMBL21912591 | 0.77 | ACHE (0.39) | TSHRNPC1ACHEMEN1RAB9A | |
| SCHEMBL14394902 | 0.77 | CYP3A4 (0.48) | NPC1MEN1RAB9AKMT2ASMN1; SMN2 | |
| SCHEMBL46965 | 0.76 | ALDH1A1 (0.40) | ALDH1A1TDP1TSHRLMNAPRSS1 | |
| SCHEMBL24283462 | 0.74 | ALDH1A1 (0.40) | ALDH1A1TSHR | |
| SCHEMBL24980513 | 0.71 | CYP1A2 (0.38) | ALDH1A1TDP1LMNANPC1NQO2 | |
| SCHEMBL13212701 | 0.71 | RXRB (0.45) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| SCHEMBL13890653 | 0.71 | — | — |
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-2006019768-A1 | HYDANTOIN DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISORDERS | SCHERING CORPORATION (US) | 2006-02-23 | — | — | WO | disclosed |