Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | LTA4H | P09960 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | IGLV6-57 | P01721 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11698998 | 0.83 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1MAPTKDM4ELMNA | |
| SCHEMBL11134983 | 0.82 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1MAPTKDM4ELMNA | |
| SCHEMBL8017515 | 0.81 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1TDP1MAPTKDM4E | |
| SCHEMBL14940641 | 0.80 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1MAPTKDM4ELMNA | |
| SCHEMBL11458539 | 0.76 | SMN1; SMN2 (0.47) | ALDH1A1L3MBTL1TDP1MAPTKDM4E | |
| SCHEMBL2945669 | 0.76 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1TDP1MAPTKDM4E | |
| SCHEMBL11692994 | 0.76 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1MAPTKDM4ESMN1; SMN2 | |
| SCHEMBL2845181 | 0.75 | ALDH1A1 (0.63) | ALDH1A1L3MBTL1TDP1MAPTKDM4E | |
| SCHEMBL8070032 | 0.75 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1MAPTKDM4ELMNA | |
| SCHEMBL11233456 | 0.75 | ALDH1A1 (0.54) | ALDH1A1L3MBTL1MAPTLMNASMN1; SMN2 |
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-4002616-A | POLYESTERS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-01-11 | — | — | US | disclosed |
| US-3962220-A | ONE-STEP, AROMATIC ALDEHYDES, ACETIC ACID | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-06-08 | — | — | US | disclosed |
| US-3962221-A | CONDENSATION, REDUCTION, OXIDATION | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-06-08 | — | — | US | disclosed |