Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | THRB | P10828 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9169974 | 1.00 | ALDH1A1 (0.60) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL6545851 | 1.00 | ALDH1A1 (0.60) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL7030032 | 1.00 | ALDH1A1 (0.60) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL9618547 | 0.99 | ALDH1A1 (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| Hydrochloric Acid SCHEMBL27904646 | 0.99 | ALDH1A1 (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| Hydrochloric Acid SCHEMBL27904644 | 0.99 | ALDH1A1 (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL9020782 | 0.91 | ALDH1A1 (0.58) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL11769408 | 0.90 | TP53 (0.49) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL2880995 | 0.87 | MME (0.58) | — | |
| SCHEMBL7165248 | 0.87 | MME (0.58) | — |
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-4613460-A | ARTIFICIAL SWEETENER | DE.BI DERIVATI BIOLOGICI INTERNATIONAL S.P.A. (IT) | 1986-09-23 | — | — | US | disclosed |
| EP-0149263-A2 | Process for preparing alpha-L-aspartyl-L-phenylalanine methyl ester | DE-BI DERIVATI BIOLOGICI INTERNATIONAL S.p.A. (IT) | 1985-07-24 | — | — | EP | disclosed |