Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 7/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | NSD2 | O96028 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11318929 | 0.83 | ALDH1A1 (0.68) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 | |
| SCHEMBL8744231 | 0.79 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 | |
| SCHEMBL9490419 | 0.77 | ALDH1A1 (0.58) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 | |
| SCHEMBL3276062 | 0.74 | ALDH1A1 (1.00) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 | |
| SCHEMBL155146 | 0.72 | ALDH1A1 (0.69) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 | |
| SCHEMBL11327656 | 0.72 | SMN1; SMN2 (1.00) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 | |
| SCHEMBL11577441 | 0.72 | ALDH1A1 (0.68) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 | |
| SCHEMBL10355745 | 0.71 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 | |
| SCHEMBL28089412 | 0.71 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 | |
| SCHEMBL27987835 | 0.71 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRSMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0371362-B1 | PROCESS FOR THE PREPARATION OF 1-NITRO, 2-CARBOXY-ANTHRAQUINONE | BASF Aktiengesellschaft (DE) | 1993-02-03 | — | — | EP | disclosed |
| US-4950756-A | OXIDATION OF 2-SUBSTITUTED 1-NITROANTHRAQUINONE | BASF AKTIENGESELLSCHAFT (DE) | 1990-08-21 | — | — | US | disclosed |
| EP-0371362-A2 | Process for the preparation of 1-Nitro, 2-carboxy-anthraquinone | BASF Aktiengesellschaft (DE) | 1990-06-06 | — | — | EP | disclosed |