Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | PLK1 | P53350 | 5/20 | 0.33 |
| ▸ | PLK3 | Q9H4B4 | 5/20 | 0.33 |
| ▸ | SCD | O00767 | 5/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.32 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.32 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.31 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8577125 | 0.85 | KCNQ3 (0.33) | ALDH1A1MAPTSMN1; SMN2TRPV1KCNK3 | |
| SCHEMBL8574490 | 0.81 | MPL (0.31) | MAPTSMN1; SMN2NPSR1TRPV1KMT2A | |
| SCHEMBL8579071 | 0.80 | NPC1 (0.42) | MAPTSMN1; SMN2KMT2ANPC1RAB9A | |
| SCHEMBL8578880 | 0.79 | TRPV1 (0.32) | PLK1PLK3TRPV1NPC1RAB9A | |
| SCHEMBL8501003 | 0.79 | CTSL (0.36) | ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8501239 | 0.79 | NPSR1 (0.33) | NPSR1KMT2ACNR1CNR2CYP1A2 | |
| SCHEMBL8576959 | 0.79 | NR3C1 (0.34) | ALDH1A1MAPTHTTSMN1; SMN2NPSR1 | |
| SCHEMBL8573318 | 0.77 | TRPV1 (0.40) | ALDH1A1MAPTSMN1; SMN2TRPV1KCNK3 | |
| SCHEMBL8485545 | 0.77 | NPSR1 (0.40) | NPSR1KMT2A | |
| SCHEMBL8501052 | 0.76 | NPSR1 (0.33) | NPSR1CNR1CNR2CYP1A2CYP3A4 |
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-5760246-A | ANTILIPEMIC AGENTS, ANTICHOLESTEROL AGENTS | BRISTOL-MYERS SQUIBB COMPANY | 1998-06-02 | — | — | US | disclosed |