Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27645574 | 0.80 | ALDH1A1 (0.70) | TDP1MAPTMAPK1L3MBTL1ALDH1A1 | |
| SCHEMBL9076056 | 0.80 | TDP1 (0.53) | TDP1MAPTL3MBTL1ALDH1A1PKM | |
| SCHEMBL700473 | 0.79 | TDP1 (0.72) | TDP1MAPTMAPK1L3MBTL1ALDH1A1 | |
| SCHEMBL31148308 | 0.79 | TDP1 (0.72) | TDP1MAPTMAPK1L3MBTL1ALDH1A1 | |
| SCHEMBL961310 | 0.78 | TSHR (0.67) | TDP1MAPTMAPK1L3MBTL1ALDH1A1 | |
| SCHEMBL14641737 | 0.78 | TDP1 (0.69) | TDP1MAPTMAPK1L3MBTL1ALDH1A1 | |
| Methyl Alcohol SCHEMBL27492265 | 0.76 | TDP1 (0.67) | TDP1MAPTL3MBTL1ALDH1A1PKM | |
| SCHEMBL3849609 | 0.76 | TDP1 (0.60) | TDP1MAPTMAPK1L3MBTL1ALDH1A1 | |
| SCHEMBL10650196 | 0.75 | TDP1 (0.55) | TDP1MAPTL3MBTL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL715298 | 0.75 | TDP1 (0.64) | TDP1MAPTMAPK1L3MBTL1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5506234-A | PSYCHOPHARMACEUTICAL AGENTS WHICH BIND TO BENZODIAZEPINE RECEPTORS; ANXIOLYTIC AGENTS; MINIMAL SIDE EFFECTS | SCHERING AKTIENGESELLSCHAFT (DE) | 1996-04-09 | — | — | US | disclosed |
| EP-0557497-A1 | NEW $g(b)-CARBOLIN DERIVATIVES, THEIR PREPARATION AND THEIR USE IN DRUGS | SCHERING AKTIENGESELLSCHAFT (DE) | 1993-09-01 | — | — | EP | disclosed |
| WO-1993006100-A1 | NEW β-CARBOLIN DERIVATIVES, THEIR PREPARATION AND THEIR USE IN DRUGS | SCHERING AKTIENGESELLSCHAFT (DE) | 1993-04-01 | — | — | WO | disclosed |