Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 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 | |
|---|---|---|---|---|
| SCHEMBL1469667 | 0.92 | ALDH1A1 (0.41) | ALDH1A1LMNAATMCA1TSHR | |
| SCHEMBL1469067 | 0.88 | ALDH1A1 (0.39) | ALDH1A1LMNAATMCA1TSHR | |
| SCHEMBL1471852 | 0.86 | ALDH1A1 (0.47) | ALDH1A1LMNAATMTSHRHPGD | |
| SCHEMBL1469289 | 0.85 | ALDH1A1 (0.43) | ALDH1A1LMNAATMTSHRHPGD | |
| SCHEMBL7714262 | 0.85 | ALDH1A1 (0.36) | ALDH1A1LMNAATMCA1TSHR | |
| SCHEMBL1468621 | 0.82 | NAAA (0.47) | ALDH1A1LMNAATMTSHR | |
| SCHEMBL4398485 | 0.82 | ATM (0.36) | ALDH1A1LMNAATMCA1TSHR | |
| SCHEMBL133243 | 0.82 | ALDH1A1 (0.50) | ALDH1A1LMNAATMCA1TSHR | |
| SCHEMBL5933221 | 0.82 | ALDH1A1 (0.40) | ALDH1A1LMNAATMCA1TSHR | |
| SCHEMBL7716277 | 0.82 | ALDH1A1 (0.40) | ALDH1A1LMNAATMCA1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5789499-A | RETAINING EFFECT OF ANTIFOULING AGENT IN A COATED POLYMERIZATION REACTOR | MITSUI CHEMICALS, INC. (JP) | 1998-08-04 | — | — | US | disclosed |