Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 1/20 | 0.48 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | SI | P14410 | 1/20 | 0.44 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7225022 | 0.89 | NPC1 (0.42) | MMP13ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7077992 | 0.89 | MMP13 (0.46) | MMP13ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7075008 | 0.89 | MMP13 (0.46) | MMP13ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7226103 | 0.89 | SLC9A1 (0.47) | ALDH1A1MAPTMEN1KMT2ANPC1 | |
| SCHEMBL7225131 | 0.88 | ALDH1A1 (0.45) | MMP13ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7232663 | 0.88 | ALDH1A1 (0.45) | ALDH1A1MAPTMEN1KMT2APOLB | |
| Hydrochloric Acid SCHEMBL7075860 | 0.88 | MMP13 (0.45) | MMP13ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7233288 | 0.88 | NPC1 (0.46) | MMP13ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7226086 | 0.88 | SCN10A (0.50) | MMP13ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7232288 | 0.87 | ALDH1A1 (0.44) | MMP13ALDH1A1MAPTMEN1KMT2A |
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 |