Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.47 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | TACR1 | P25103 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8724389 | 0.88 | ATM (0.63) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL2734812 | 0.88 | ATM (0.63) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL3725043 | 0.88 | ATM (0.63) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL8724387 | 0.86 | ATM (0.61) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL7327532 | 0.86 | ATM (0.61) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL1324552 | 0.85 | ATM (0.49) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL2059140 | 0.85 | TACR1 (0.58) | ALDH1A1POLBTACR1ITGA4ITGB7 | |
| SCHEMBL1093320 | 0.85 | ATM (0.49) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL4765072 | 0.85 | MMP8 (0.59) | ATMALDH1A1THRBCYP2C9CYP2C19 | |
| SCHEMBL28803420 | 0.85 | ATM (0.49) | ATMALDH1A1THRBCYP2C9CYP2C19 |
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-0787140-A4 | PROCESS FOR PERFORMING RETRO-ALDOL REACTION | LILLY CO ELI (US) | 1999-04-14 | — | — | EP | disclosed |
| EP-0787140-A1 | PROCESS FOR PERFORMING RETRO-ALDOL REACTION | ELI LILLY AND COMPANY (US) | 1997-08-06 | — | — | EP | disclosed |
| WO-1996015142-A1 | PROCESS FOR PERFORMING RETRO-ALDOL REACTION | ELI LILLY AND COMPANY (US) | 1996-05-23 | — | — | WO | disclosed |