Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.39 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | KDM6B | O15054 | 1/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.38 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.38 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14250023 | 0.84 | PARP1 (0.37) | CYP3A4ALDH1A1TSHRGABRA1GABRA5 | |
| Hydrochloric Acid SCHEMBL1439124 | 0.82 | PARP1 (0.36) | CYP3A4ALDH1A1TSHRGABRA1GABRA5 | |
| SCHEMBL14949552 | 0.81 | NPC1 (0.36) | CYP3A4ALDH1A1TSHRGABRA1GABRA5 | |
| SCHEMBL3613510 | 0.72 | IDO1 (0.42) | CYP3A4ALDH1A1KDM4EPMP22NPSR1 | |
| SCHEMBL21713005 | 0.70 | CYP3A4 (0.39) | CYP3A4ALDH1A1TSHRGABRA1GABRA5 | |
| SCHEMBL798220 | 0.68 | NAPRT (0.45) | CYP3A4ALDH1A1TSHRGABRA1GABRA5 | |
| SCHEMBL4067921 | 0.68 | ALDH1A1 (0.34) | CYP3A4ALDH1A1IDO1SMN1; SMN2 | |
| SCHEMBL1402162 | 0.68 | IDO1 (0.41) | CYP3A4ALDH1A1TSHRMAPTNPSR1 | |
| SCHEMBL13725534 | 0.68 | KMT2A (0.33) | CYP3A4ALDH1A1TSHRKDM4EBLM | |
| 4-Imidazolecarboxylic Acid SCHEMBL28085192 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4238967-A1 | ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF | Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) | 2023-09-06 | — | — | EP | disclosed |
| CN-103582644-B | Phthalazinone-Pyrrolopyrimidine Carboxamide Derivatives | 塔科达有限责任公司 | 2016-07-20 | — | — | CN | disclosed |