Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Ethylbenzene SCHEMBL891495 | 0.82 | TP53 (0.67) | NPSR1NPC1RAB9ATP53CYP1A2 | |
| SCHEMBL306337 | 0.82 | — | — | |
| SCHEMBL29697291 | 0.82 | — | — | |
| SCHEMBL3617649 | 0.81 | RAPGEF4 (0.55) | MAPTNPC1RAB9ATP53RAPGEF4 | |
| Hydrochloric Acid SCHEMBL2872234 | 0.80 | MAPT (0.58) | NPSR1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL24146817 | 0.79 | MAPT (0.48) | NPSR1MAPTNPC1RAB9ARECQL | |
| Ethylbenzene SCHEMBL10661635 | 0.79 | MAPT (0.59) | NPSR1MAPTNPC1RAB9ATP53 | |
| Hydrochloric Acid SCHEMBL2868312 | 0.79 | RAPGEF4 (0.53) | MAPTNPC1RAB9ARAPGEF4KMT2A | |
| Ethylbenzene SCHEMBL11134930 | 0.79 | TP53 (0.61) | NPSR1NPC1RAB9ATP53CYP1A2 | |
| Phenol SCHEMBL6881606 | 0.78 | NPSR1 (0.57) | NPSR1MAPTCYP1A2CYP3A4CYP2D6 |
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-4313872-A | MONDAZO AND DISAZO DYES | CASSELLA AKTIENGESELLSCHAFT (DE) | 1982-02-02 | — | — | US | disclosed |