Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HBB | P68871 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL8167544 | 0.73 | TDP1 (0.38) | ALDH1A1KDM4EGLA | |
| SCHEMBL17490535 | 0.73 | SLC9A1 (0.44) | ALDH1A1KDM4EGLA | |
| SCHEMBL11414767 | 0.68 | ALDH1A1 (0.33) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL8108558 | 0.68 | HSP90AA1 (0.35) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL22471432 | 0.68 | PGR (0.36) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL12657637 | 0.68 | ADORA2A (0.41) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL6808692 | 0.68 | ALDH1A1 (0.33) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL22846898 | 0.67 | ALDH1A1 (0.32) | ALDH1A1LMNAMAPTCYP19A1TSHR | |
| SCHEMBL15421579 | 0.67 | — | — | |
| SCHEMBL22847505 | 0.66 | ADRA1D (0.37) | ALDH1A1LMNAMAPTCYP19A1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-56128769-A | — | — | None | — | — | JP | disclosed |
| WO-2017053391-A1 | MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2017-03-30 | — | — | WO | disclosed |
| JP-S56128769-A | AMINO-5-FLUOROURACIL DERIVATIVE AND ITS PREPARATION | TAIHO YAKUHIN KOGYO KK | 1981-10-08 | — | — | JP | disclosed |