Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | CASP2 | P42575 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | CASP6 | P55212 | 1/20 | 0.47 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | MITF | O75030 | 1/20 | 0.44 |
| ▸ | XBP1 | P17861 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9485394 | 0.89 | ALDH1A1 (0.50) | ALDH1A1MAPTCASP3POLBMEN1 | |
| SCHEMBL4683731 | 0.85 | CYP1A2 (0.56) | TP53THRBALDH1A1MAPTPOLB | |
| SCHEMBL9320361 | 0.85 | NPC1 (0.61) | TP53ALDH1A1MAPTCASP3CASP2 | |
| SCHEMBL1325326 | 0.81 | ALDH1A1 (0.66) | TP53ALDH1A1MAPTNPC1SMN1; SMN2 | |
| SCHEMBL2205077 | 0.81 | CYP1A1 (0.67) | TP53ALDH1A1MAPTCASP3CASP2 | |
| SCHEMBL10734378 | 0.81 | ALDH1A1 (0.68) | ALDH1A1MAPTNPC1SMN1; SMN2HPGD | |
| SCHEMBL10412724 | 0.80 | TP53 (0.56) | TP53ALDH1A1POLBCYP1A1MEN1 | |
| SCHEMBL7366105 | 0.80 | THRA (0.63) | THRBALDH1A1NPC1SMN1; SMN2POLB | |
| SCHEMBL3317660 | 0.79 | HDAC3 (0.62) | TP53THRBALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL11720766 | 0.79 | KMT2A (0.68) | TP53NPC1SMN1; SMN2POLBHPGD |
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-5223510-A | ALKYLAMINOALKYL DERIVATIVES OF BENZOFURAN, BENZOTHIOPHENE, INDOLE AND INDOLIZINE, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM | SANOFI (FR) | 1993-06-29 | — | — | US | disclosed |