Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 3/20 | 0.60 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.59 |
| ▸ | WNT3A | P56704 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 6/20 | 0.55 |
| ▸ | RAB9A | P51151 | 5/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8699595 | 0.80 | KMT2A (0.61) | EDNRACTNNB1WNT3ANPC1RAB9A | |
| SCHEMBL21656188 | 0.76 | EDNRA (0.62) | EDNRANPC1RAB9AMAPK9SMN1; SMN2 | |
| SCHEMBL25222311 | 0.76 | HPGD (0.69) | CTNNB1WNT3ANPC1RAB9ATP53 | |
| SCHEMBL15968735 | 0.75 | CTNNB1 (1.00) | CTNNB1WNT3ANPC1RAB9ATP53 | |
| SCHEMBL7498975 | 0.73 | EDNRA (0.58) | EDNRANPC1RAB9AMAPK9SMN1; SMN2 | |
| SCHEMBL11778538 | 0.72 | MAPK9 (0.76) | EDNRACTNNB1WNT3ANPC1RAB9A | |
| SCHEMBL7842141 | 0.72 | KMT2A (0.58) | EDNRACTNNB1WNT3ANPC1RAB9A | |
| SCHEMBL7593216 | 0.72 | RAB9A (0.54) | EDNRANPC1RAB9AMAPTHPGD | |
| SCHEMBL22404286 | 0.71 | EDNRA (0.56) | EDNRAHPGDSMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL805660 | 0.70 | EDNRA (0.55) | EDNRAHPGDSMN1; SMN2KMT2AALDH1A1 |
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-1998015524-A1 | IMPROVED PROCESS FOR THE SYNTHESIS OF BETA-KETONITRILES | WARNER-LAMBERT COMPANY (US) | 1998-04-16 | — | — | WO | disclosed |