Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9372300 | 0.99 | KDM1A (0.41) | KDM1AHTR2CHTR2BHSD11B1SMN1; SMN2 | |
| SCHEMBL9544220 | 0.82 | HTR2B (0.47) | KDM1AHTR2CHTR2BMEN1KMT2A | |
| SCHEMBL23037546 | 0.82 | KDM1A (0.47) | KDM1AHTR2CHTR2BHSD11B1CYP1A2 | |
| SCHEMBL6592538 | 0.81 | NCF1 (0.47) | SMN1; SMN2MEN1KMT2ACYP1A2NPC1 | |
| SCHEMBL6589107 | 0.81 | CYP1A2 (0.44) | SMN1; SMN2MEN1KMT2ACYP1A2NPC1 | |
| SCHEMBL6185025 | 0.80 | NCF1 (0.51) | SMN1; SMN2MEN1KMT2ACYP1A2NPC1 | |
| SCHEMBL9375448 | 0.80 | CYP11B1 (0.43) | KDM1AHTR2CHTR2BMEN1KMT2A | |
| SCHEMBL7381173 | 0.78 | GRM2 (0.44) | SMN1; SMN2MEN1KMT2ACYP1A2LMNA | |
| SCHEMBL6593276 | 0.78 | CYP1A2 (0.41) | SMN1; SMN2MEN1KMT2ACYP1A2NPC1 | |
| SCHEMBL9190817 | 0.78 | ALDH1A1 (0.43) | KDM1ASMN1; SMN2MEN1KMT2ACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1150977-A1 | PHENYL UREA AND PHENYL THIOUREA DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 2001-11-07 | — | — | EP | claimed |
| WO-2000047577-A1 | PHENYL UREA AND PHENYL THIOUREA DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 2000-08-17 | — | — | WO | claimed |
| WO-1993018028-A1 | INDOLE DERIVATIVES AS 5HT1C ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-09-16 | — | — | WO | claimed |