Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | TTK | P33981 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.36 |
| ▸ | WNT3A | P56704 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL28740575 | 0.82 | CYP1A2 (0.41) | CYP1A2KDM4ESTAT3HIF1AGAA | |
| SCHEMBL6461006 | 0.80 | KDM4E (0.58) | CYP1A2KDM4ESTAT3HIF1AGAA | |
| SCHEMBL29879486 | 0.80 | KDM4E (0.58) | CYP1A2KDM4ESTAT3HIF1AGAA | |
| Tert-Butyl Formate SCHEMBL28867288 | 0.68 | CYP3A4 (0.53) | CYP1A2KDM4EGAACYP3A4TDP1 | |
| SCHEMBL14903449 | 0.67 | RARG (0.50) | CYP1A2KDM4ESTAT3HIF1AGAA | |
| SCHEMBL21965345 | 0.67 | RARG (0.50) | CYP1A2KDM4ESTAT3HIF1AGAA | |
| Phthalazinone SCHEMBL28381422 | 0.66 | ALDH1A1 (0.68) | KDM4EGAATDP1ALDH1A1HPGD | |
| SCHEMBL5435670 | 0.65 | KDM4E (0.69) | KDM4ESTAT3HIF1AYTHDC1ALDH1A1 | |
| SCHEMBL29643994 | 0.64 | KDM4E (0.52) | CYP1A2KDM4ESTAT3HIF1AGAA | |
| SCHEMBL561564 | 0.64 | KDM4E (0.52) | CYP1A2KDM4ESTAT3HIF1AGAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-104619698-B | Pyrrolidin derivatives and the purposes as complement pathway regulator thereof | 诺华股份有限公司 | 2016-08-31 | — | — | CN | disclosed |
| CN-105121429-A | Complement pathway modulators and uses thereof | NOVARTIS AG | 2015-12-02 | — | — | CN | disclosed |
| CN-104619698-A | Pyrrolidine derivatives and their use as complement pathway modulators | NOVARTIS AG | 2015-05-13 | — | — | CN | disclosed |