Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | FABP4 | P15090 | 2/20 | 0.39 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.35 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.33 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | DDO | Q99489 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28609368 | 0.77 | HTR2A (0.42) | HTR2AHTR2CFABP4ALDH1A1P2RX7 | |
| SCHEMBL28605281 | 0.77 | NOTUM (0.50) | CYP2A6CYP1A2DAONOTUMSLC6A2 | |
| SCHEMBL28609388 | 0.77 | HTR6 (0.50) | HTR2CCYP2A6FABP4PRMT5DAO | |
| SCHEMBL28602695 | 0.74 | KDM4E (0.43) | CYP1A2FABP4ALKBH5FTOALDH1A1 | |
| SCHEMBL256208 | 0.71 | ALDH1A1 (0.50) | HTR2AHTR2CCYP2A6CYP1A2FABP4 | |
| SCHEMBL5102197 | 0.69 | HTR2A (0.51) | HTR2AHTR2CCYP2A6CYP1A2FABP4 | |
| SCHEMBL19089435 | 0.69 | HTR2A (0.47) | HTR2AHTR2CCYP2A6CYP1A2FABP4 | |
| SCHEMBL4071478 | 0.69 | HTR2A (0.51) | HTR2AHTR2CCYP2A6CYP1A2FABP4 | |
| SCHEMBL10441151 | 0.69 | HTR2A (0.47) | HTR2AHTR2CCYP2A6CYP1A2FABP4 | |
| SCHEMBL28025537 | 0.69 | HTR2A (0.47) | HTR2AHTR2CCYP2A6CYP1A2FABP4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109867694-B | Synthesis method of oxygen-guided 7-alkynyl indole compound | 华南理工大学 | 2021-07-16 | — | — | CN | disclosed |