Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.36 |
| ▸ | CCR3 | P51677 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5599501 | 0.85 | KDM1A (0.37) | TP53ALDH1A1KDM1A | |
| SCHEMBL5599739 | 0.85 | OPRM1 (0.36) | TP53RAB9AALDH1A1CRHR1KDM1A | |
| SCHEMBL5599755 | 0.84 | KDM1A (0.35) | TP53SMYD3CRHR1KDM1A | |
| SCHEMBL5616077 | 0.83 | TPSAB1 (0.38) | ALDH1A1SMYD3KDM1A | |
| SCHEMBL5599714 | 0.82 | LMNA (0.36) | TP53CRHR1CNR2KDM1A | |
| SCHEMBL5599230 | 0.82 | TPSAB1 (0.38) | ALDH1A1SMYD3KDM1A | |
| SCHEMBL5781576 | 0.81 | ALDH1A1 (0.40) | TP53ALDH1A1CCR3 | |
| SCHEMBL5783985 | 0.80 | DPP4 (0.34) | TP53HTR2CCRHR1KDM1A | |
| SCHEMBL5599358 | 0.80 | PARP1 (0.36) | TP53CRHR1KDM1A | |
| SCHEMBL5599242 | 0.79 | CYP3A4 (0.38) | TP53ALDH1A1 |
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-2005063745-A9 | NOVEL SPIROINDOLINE OR SPIROISOQUINOLINE COMPOUNDS, METHODS OF USE AND COMPOSITIONS THEREOF | ARENA PHARM INC (US) | 2007-02-01 | — | — | WO | claimed |