Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.53 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.53 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 4/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3300283 | 0.81 | CYP1A2 (0.73) | CYP1A2CYP1A1CYP1B1NFE2L2KDM4E | |
| SCHEMBL11416382 | 0.76 | RAB9A (0.43) | CYP1A2CYP1A1CYP1B1RELANFE2L2 | |
| SCHEMBL1236491 | 0.76 | ALDH1A1 (0.66) | CYP1A2CYP1A1CYP1B1NFE2L2KDM4E | |
| SCHEMBL3295740 | 0.76 | TDP1 (0.52) | CYP1A2KDM4ESMN1; SMN2MEN1NPC1 | |
| SCHEMBL3319231 | 0.76 | CYP1A2 (0.48) | CYP1A2CYP1A1CYP1B1RELANFE2L2 | |
| SCHEMBL28761484 | 0.74 | CYP1A1 (0.47) | CYP1A2CYP1A1CYP1B1RELANFE2L2 | |
| SCHEMBL16093963 | 0.74 | CYP1A2 (0.47) | CYP1A2CYP1A1CYP1B1RELANFE2L2 | |
| SCHEMBL290332 | 0.73 | TRPA1 (0.75) | CYP1B1TRPA1RELANFE2L2KDM4E | |
| SCHEMBL9732916 | 0.73 | CYP2A6 (0.50) | CYP1A2CYP1A1CYP1B1RELAKDM4E | |
| Hydrochloric Acid SCHEMBL968280 | 0.73 | CYP1A2 (0.46) | CYP1A2CYP1A1CYP1B1RELANFE2L2 |
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-0411150-B1 | INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME | OTSUKA PHARMA CO LTD (JP) | 1996-11-27 | — | — | EP | disclosed |
| US-5238938-A | Nephrosis | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1993-08-24 | — | — | US | disclosed |
| EP-0411150-A1 | INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-02-06 | — | — | EP | disclosed |