Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8574455 | 0.83 | KMT2A (0.50) | HTR4HTTCYP3A4MEN1KMT2A | |
| SCHEMBL8573179 | 0.81 | MEN1 (0.51) | ALDH1A1LMNAPOLBNPC1RAB9A | |
| SCHEMBL8575158 | 0.79 | HTR4 (0.51) | ALDH1A1HTR4LMNASMN1; SMN2 | |
| SCHEMBL8569585 | 0.78 | HTR4 (0.50) | ALDH1A1HTR4CYP3A4MEN1KMT2A | |
| SCHEMBL11694122 | 0.77 | LMNA (0.46) | ALDH1A1LMNAHTTPOLBCYP3A4 | |
| SCHEMBL14495129 | 0.77 | TTR (0.52) | ALDH1A1LMNAHTTPOLBRAB9A | |
| SCHEMBL8569565 | 0.75 | TSHR (0.43) | ALDH1A1LMNAHTTPOLBG6PD | |
| SCHEMBL5095253 | 0.75 | PKM (0.54) | ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL4138153 | 0.75 | ALDH1A1 (0.46) | ALDH1A1HTTPOLBCYP3A4MEN1 | |
| SCHEMBL8571173 | 0.75 | POLB (0.51) | ALDH1A1LMNAPOLBCYP3A4MEN1 |
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 |