Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL27123316 | 0.93 | BLM (0.50) | ALDH1A1LMNAHSD17B10CA1CYP3A4 | |
| SCHEMBL15779692 | 0.91 | CA1 (0.42) | ALDH1A1LMNAHSD17B10CA1CYP3A4 | |
| SCHEMBL15800111 | 0.91 | CA1 (0.48) | ALDH1A1LMNAHSD17B10CA1CYP3A4 | |
| SCHEMBL1722216 | 0.91 | CA1 (0.48) | ALDH1A1LMNAHSD17B10CA1CYP3A4 | |
| SCHEMBL14616914 | 0.90 | ALDH1A1 (0.48) | ALDH1A1LMNAHSD17B10CYP3A4CYP2C19 | |
| Hydrochloric Acid SCHEMBL29047451 | 0.89 | CA1 (0.47) | ALDH1A1LMNAHSD17B10CA1CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL28118106 | 0.89 | CA1 (0.47) | ALDH1A1LMNAHSD17B10CA1CYP3A4 | |
| SCHEMBL5138404 | 0.89 | CA1 (0.57) | CA1 | |
| SCHEMBL16298859 | 0.89 | CA1 (0.57) | CA1 | |
| SCHEMBL4922700 | 0.89 | CYP4F2 (0.40) | ALDH1A1LMNAHSD17B10CA1CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111630051-B | Olefin spiro compounds as farnesol X receptor modulators | 百时美施贵宝公司 | 2023-12-26 | — | — | CN | disclosed |
| CN-110167934-B | Cyclobutane-and azetidine-containing monocyclic and spiro compounds as alpha V integrin inhibitors | 百时美施贵宝公司 | 2022-06-10 | — | — | CN | disclosed |
| CN-111630051-A | Spirocyclic compounds of alkenes as farnesoid X receptor modulators | 百时美施贵宝公司 | 2020-09-04 | — | — | CN | disclosed |
| CN-107406541-A | Catalyst components for the polymerization of olefins | 巴塞尔聚烯烃意大利有限公司 | 2017-11-28 | — | — | CN | disclosed |