Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 3/20 | 0.51 |
| ▸ | HTR2C | P28335 | 2/20 | 0.51 |
| ▸ | EGFR | P00533 | 6/20 | 0.48 |
| ▸ | HTR6 | P50406 | 4/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8615090 | 0.81 | HTR6 (0.49) | HTR2BHTR2CHTR6PIK3CAMTOR | |
| SCHEMBL8622671 | 0.80 | HTR6 (0.43) | HTR2BHTR2CEGFRHTR6PIK3CA | |
| SCHEMBL6714734 | 0.74 | HTR6 (0.54) | HTR2CHTR6 | |
| SCHEMBL6719408 | 0.71 | HDAC3 (0.52) | HTR2CHTR6MAPT | |
| SCHEMBL7660298 | 0.71 | HTR2B (0.76) | HTR2BHTR2CKDM4EMAPTMEN1 | |
| SCHEMBL7654810 | 0.69 | HTR2C (0.68) | HTR2BHTR2CKDM4EMAPTNPC1 | |
| SCHEMBL8589275 | 0.69 | MEN1 (0.52) | HTR2CHTR6MAPTMEN1CYP1A2 | |
| SCHEMBL30794779 | 0.68 | HTR2C (0.70) | HTR2BHTR2CEGFR | |
| SCHEMBL5801524 | 0.68 | HTR2C (0.70) | HTR2BHTR2CEGFR | |
| Hydrochloric Acid SCHEMBL7659046 | 0.68 | HTR2C (0.66) | HTR2BHTR2CKDM4EMAPTMEN1 |
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-1998047868-A1 | HETEROCYCLE-CONTAINING UREA DERIVATIVES AS 5HT1A, 5HT1B AND 5HT1D RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1998-10-29 | — | — | WO | disclosed |