Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.38 |
| ▸ | THPO | P40225 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9730719 | 0.81 | TDP1 (0.48) | ALDH1A1L3MBTL1RAD52SMN1; SMN2CYP3A4 | |
| SCHEMBL31696766 | 0.81 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1RAD52SMN1; SMN2CYP3A4 | |
| SCHEMBL10333910 | 0.80 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1RAD52SMN1; SMN2CYP3A4 | |
| SCHEMBL11265833 | 0.80 | TYR (0.41) | ALDH1A1L3MBTL1RAD52SMN1; SMN2CYP3A4 | |
| SCHEMBL16970730 | 0.74 | S100B (0.46) | ALDH1A1L3MBTL1RAD52SMN1; SMN2CYP3A4 | |
| SCHEMBL9513863 | 0.73 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1SMN1; SMN2CYP3A4HIF1A | |
| SCHEMBL3213200 | 0.73 | CYP2A6 (0.47) | ALDH1A1L3MBTL1CYP3A4MAPTALOX15 | |
| SCHEMBL896520 | 0.71 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CYP3A4HIF1AMAPT | |
| Hydrochloric Acid SCHEMBL8509062 | 0.70 | ALDH1A1 (0.42) | ALDH1A1RAD52SMN1; SMN2CYP3A4HIF1A | |
| SCHEMBL11638889 | 0.70 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1SMN1; SMN2CYP3A4HIF1A |
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-4017471-A | ANTITUMOR AGENT | G. D. SEARLE & CO. (EN) | 1977-04-12 | — | — | US | claimed |
| US-4017471-A | ANTITUMOR AGENT | G. D. SEARLE & CO. (EN) | 1977-04-12 | — | — | US | disclosed |