Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | PLAT | P00750 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GPX4 | P36969 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | ALPI | P09923 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALPG | P10696 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL27582981 | 0.86 | PLAT (0.46) | NR1I2PLATNPC1ALDH1A1TP53 | |
| SCHEMBL3085828 | 0.86 | NR1I2 (0.49) | NR1I2PLATNPC1ALDH1A1TP53 | |
| SCHEMBL6547355 | 0.80 | ESR1 (0.46) | CTSBTAAR1ALDH1A1ALPLALPI | |
| SCHEMBL20862381 | 0.79 | PLAT (0.44) | NR1I2PLATALDH1A1ACP3 | |
| SCHEMBL28187666 | 0.79 | CSNK1E (0.47) | CTSBCSNK1ETAAR1NPC1ALDH1A1 | |
| SCHEMBL8860503 | 0.78 | CYP19A1 (0.51) | NPC1ALDH1A1TP53GPX4RAB9A | |
| SCHEMBL5271972 | 0.78 | CSNK1E (0.55) | CSNK1ENR1I2ALDH1A1 | |
| SCHEMBL8086957 | 0.78 | CSNK1E (0.55) | CSNK1ENR1I2ALDH1A1 | |
| SCHEMBL8860487 | 0.78 | CYP19A1 (0.51) | NPC1ALDH1A1TP53GPX4RAB9A | |
| SCHEMBL8101522 | 0.78 | CSNK1E (0.55) | CSNK1ENR1I2ALDH1A1 |
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-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |