Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.45 |
| ▸ | HMGCR | P04035 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8575158 | 0.89 | HTR4 (0.51) | HTR4HTR2AHTR2CHTR2B | |
| SCHEMBL8569585 | 0.88 | HTR4 (0.50) | KMT2ACYP3A4HTR4HDAC8HDAC1 | |
| SCHEMBL8572525 | 0.83 | ALDH1A1 (0.56) | KMT2AHDAC8HDAC1MEN1 | |
| SCHEMBL8570776 | 0.83 | ALDH1A1 (0.42) | KMT2ACYP3A4HTR4MEN1HTT | |
| SCHEMBL10792266 | 0.83 | KMT2A (0.53) | KMT2ACYP3A4HTR4HMGCRHDAC8 | |
| SCHEMBL7357981 | 0.82 | HTR4 (0.67) | KMT2AHTR4MEN1 | |
| SCHEMBL1441802 | 0.82 | KMT2A (0.49) | KMT2ACYP3A4HTR4HMGCRHDAC8 | |
| SCHEMBL8571284 | 0.81 | RAB9A (0.58) | KMT2AHDAC1MEN1HTT | |
| SCHEMBL8571105 | 0.81 | HTR2A (0.55) | KMT2AMEN1HTR2AHTR2CHTR2B | |
| SCHEMBL8572360 | 0.81 | HTR2A (0.54) | KMT2AHTR4HDAC8HDAC1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5739336-A | SELECTIVE 5-HYDROXYTRYPTAMINE-2C RECEPTOR ANTAGONISTS | SYNTEX (U.S.A.) INC. (US) | 1998-04-14 | — | — | US | disclosed |
| WO-1997000872-A1 | 1,3,8-TRIAZA- AND 3,8-DIAZA-1-OXASPIRO(4,5)DECANE DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 1997-01-09 | — | — | WO | disclosed |