Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | PRKCB | P05771 | 2/20 | 0.32 |
| ▸ | PRKCA | P17252 | 2/20 | 0.32 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL7229598 | 0.89 | ALDH1A1 (0.42) | MRGPRX1KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL7224864 | 0.86 | ANO1 (0.35) | MRGPRX1PRKCBCXCR2CHRNA7 | |
| SCHEMBL7233624 | 0.85 | KDM1A (0.33) | PTGS1PTGS2PRKCBPRKCAPRKCE | |
| SCHEMBL7232823 | 0.85 | EPHX2 (0.36) | CHRNA7 | |
| SCHEMBL7233645 | 0.84 | PTPN1 (0.42) | PTK2CA2 | |
| SCHEMBL7225638 | 0.84 | SMN1; SMN2 (0.36) | ALDH1A1CXCR2CHRNA7 | |
| SCHEMBL7224194 | 0.83 | CHRNA7 (0.35) | CHRNA7 | |
| SCHEMBL7233015 | 0.83 | CHRNA7 (0.39) | PRKCBPRKCAPRKCEKDM4EALDH1A1 | |
| SCHEMBL7232082 | 0.82 | CXCR2 (0.34) | MRGPRX1ALDH1A1CXCR2CHRNA7 | |
| SCHEMBL7230631 | 0.81 | CHRNA7 (0.33) | CHRNA7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6562816-B2 | Alpha 7 nicotine acetylcholine receptor agonist anti-psychotic agent, with reduced side effects | PHARMACIA & UPJOHN COMPANY | 2003-05-13 | — | — | US | claimed |
| US-6562816-B2 | Alpha 7 nicotine acetylcholine receptor agonist anti-psychotic agent, with reduced side effects | PHARMACIA & UPJOHN COMPANY | 2003-05-13 | — | — | US | disclosed |