Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | TSHR | P16473 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 8/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5599305 | 0.81 | HPGD (0.41) | NPC1RAB9AALDH1A1TSHRLMNA | |
| SCHEMBL5782188 | 0.80 | MEN1 (0.41) | NPC1RAB9ALMNACYP3A4CYP2D6 | |
| SCHEMBL5599174 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TSHRLMNAGAASMN1; SMN2 | |
| SCHEMBL5783881 | 0.72 | TSHR (0.49) | RAB9AALDH1A1TSHRHPGDGAA | |
| SCHEMBL5599295 | 0.71 | TSHR (0.47) | ALDH1A1TSHRHPGDGAACYP3A4 | |
| SCHEMBL5786199 | 0.69 | SIGMAR1 (0.43) | ALDH1A1TSHRLMNACYP2C19SMN1; SMN2 | |
| SCHEMBL14638336 | 0.68 | ALDH1A1 (0.56) | NPC1RAB9AALDH1A1LMNAHPGD | |
| SCHEMBL7464300 | 0.67 | HPGD (0.75) | NPC1ALDH1A1TSHRLMNAHPGD | |
| SCHEMBL5599732 | 0.64 | SMN1; SMN2 (0.38) | ALDH1A1LMNAGAASMN1; SMN2NPSR1 | |
| SCHEMBL26413626 | 0.64 | ALDH1A1 (0.47) | NPC1RAB9AALDH1A1TSHRHPGD |
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 |