Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 5/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | STS | P08842 | 1/20 | 0.42 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11575811 | 0.90 | TSHR (0.58) | ALDH1A1POLBLMNATSHRTDP1 | |
| SCHEMBL22441909 | 0.87 | TSHR (0.59) | ALDH1A1POLBLMNATSHRTDP1 | |
| SCHEMBL11575918 | 0.87 | CA12 (0.50) | ALDH1A1POLBTSHRTDP1KDM4E | |
| Butane SCHEMBL15104922 | 0.83 | POLB (0.60) | ALDH1A1POLBLMNATDP1L3MBTL1 | |
| SCHEMBL17713249 | 0.83 | ALDH1A1 (0.54) | ALDH1A1POLBLMNATSHRTDP1 | |
| SCHEMBL20061899 | 0.81 | POLB (0.48) | ALDH1A1POLBLMNATSHRTDP1 | |
| SCHEMBL27534694 | 0.81 | ALDH1A1 (0.60) | ALDH1A1POLBLMNATSHRTDP1 | |
| SCHEMBL829907 | 0.81 | ALDH1A1 (0.60) | ALDH1A1POLBLMNATSHRTDP1 | |
| SCHEMBL11577038 | 0.81 | ALDH1A1 (0.60) | ALDH1A1POLBLMNATSHRTDP1 | |
| SCHEMBL827862 | 0.81 | ALDH1A1 (0.60) | ALDH1A1POLBLMNATSHRTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4097456-A | Preparation of acetylene-substituted polyimide oligomers and polyimide polymers | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1978-06-27 | — | — | US | disclosed |