Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.67 |
| ▸ | MAOA | P21397 | 2/20 | 0.67 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.59 |
| ▸ | HTR3A | P46098 | 1/20 | 0.59 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.59 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.55 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | SCN1A | P35498 | 2/20 | 0.51 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9796885 | 0.85 | ESR1 (0.66) | LMNACYP1A2TSHRCYP2D6CYP2C19 | |
| Benzoic Acid Diethylcarbamoylmethyl Ester SCHEMBL9653185 | 0.83 | LMNA (0.56) | LMNANPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL14034893 | 0.83 | LMNA (0.66) | LMNACYP1A2CYP3A4MAOATSHR | |
| Benzocaine SCHEMBL1235972 | 0.81 | LMNA (1.00) | LMNACYP1A2CYP3A4MAOATSHR | |
| Benzocaine SCHEMBL25100 | 0.81 | LMNA (1.00) | LMNACYP1A2CYP3A4MAOATSHR | |
| SCHEMBL11375136 | 0.80 | LMNA (0.77) | LMNACYP1A2CYP3A4MAOATSHR | |
| Benzocaine SCHEMBL11021778 | 0.79 | LMNA (0.96) | LMNACYP1A2CYP3A4MAOATSHR | |
| Benzocaine SCHEMBL27914401 | 0.79 | LMNA (0.96) | LMNACYP1A2CYP3A4MAOATSHR | |
| Benzocaine SCHEMBL15200678 | 0.79 | LMNA (0.96) | LMNACYP1A2CYP3A4MAOATSHR | |
| Benzocaine SCHEMBL19031788 | 0.79 | LMNA (0.96) | LMNACYP1A2CYP3A4MAOATSHR |
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-5073641-A | PRODRUG DERIVATIVES OF CARBOXYLIC ACID DRUGS | BUNDGAARD HANS (DK) | 1991-12-17 | — | — | US | disclosed |
| EP-0278977-A1 | PRODRUG DERIVATIVES OF CARBOXYLIC ACID DRUGS. | BUNDGAARD HANS (DK) | 1988-08-24 | — | — | EP | disclosed |
| WO-1988001615-A1 | PRODRUG DERIVATIVES OF CARBOXYLIC ACID DRUGS | BUNDGAARD HANS (DK) | 1988-03-10 | — | — | WO | disclosed |