Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.64 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | BRD4 | O60885 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.49 |
| ▸ | CCR2 | P41597 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL25758177 | 0.83 | KDM4E (0.63) | HTR2CADRB2KDM4EATMBRD4 | |
| SCHEMBL5374774 | 0.82 | CCR2 (0.61) | HTR2CADRB2KDM4EBRD4ALDH1A1 | |
| SCHEMBL5946890 | 0.81 | CCR2 (0.71) | HTR2CADRB2CCR2 | |
| SCHEMBL373923 | 0.80 | HTR2C (1.00) | HTR2CADRB2KDM4EATMBRD4 | |
| SCHEMBL29502102 | 0.80 | HTR2C (1.00) | HTR2CADRB2KDM4EATMBRD4 | |
| SCHEMBL30909145 | 0.79 | KDM4E (0.58) | HTR2CADRB2KDM4EATMBRD4 | |
| Hydrochloric Acid SCHEMBL31285949 | 0.78 | HTR2C (1.00) | HTR2CADRB2KDM4EATMBRD4 | |
| Methane SCHEMBL10788775 | 0.78 | HTR2C (0.97) | HTR2CADRB2KDM4EATMBRD4 | |
| Hydrochloric Acid SCHEMBL893070 | 0.78 | HTR2C (1.00) | HTR2CADRB2KDM4EATMBRD4 | |
| SCHEMBL5947004 | 0.78 | CCR2 (0.67) | HTR2CADRB2KDM4EBRD4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002079190-A1 | 3-SUBSTITUTED INDOLES AS CHEMOKINE ANTAGONISTS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-10-10 | — | — | WO | disclosed |