Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.35 |
| ▸ | MAPT | P10636 | 8/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 7/20 | 0.33 |
| ▸ | GFER | P55789 | 5/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA9 | Q16790 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21646381 | 0.84 | PRKCI (0.40) | TDP1KDM4EMAPTNPC1GAA | |
| SCHEMBL4167680 | 0.79 | TDP1 (0.39) | TDP1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL12287691 | 0.79 | TDP1 (0.46) | TDP1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7589418 | 0.77 | CASP1 (0.44) | TDP1CYP3A4KDM4EMAPTNPC1 | |
| Hydrochloric Acid SCHEMBL28937662 | 0.75 | CASP1 (0.42) | TDP1CYP3A4KDM4EMAPTNPC1 | |
| SCHEMBL14218921 | 0.73 | TDP1 (0.54) | TDP1CYP3A4KDM4EMAPTNPC1 | |
| SCHEMBL31470604 | 0.73 | TDP1 (0.35) | TDP1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9505716 | 0.73 | MAPT (0.38) | TDP1LMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27870146 | 0.73 | ALDH1A1 (0.48) | TDP1LMNACYP3A4IDO1KDM4E | |
| SCHEMBL21594550 | 0.72 | PTK2 (0.38) | GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3339305-A1 | INDOLE DERIVATIVE, PREPARATION METHOD THEREOF, AND USE THEREOF IN PHARMACEUTICAL DRUG | Zhejiang Hisun Pharmaceutical Co., Ltd (CN) | 2018-06-27 | — | — | EP | disclosed |