Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 9/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | EBP | Q15125 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL7221784 | 0.81 | LTA4H (0.55) | LTA4HHRH3KDM4EALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL7221119 | 0.80 | LTA4H (0.54) | LTA4HHRH3ALDH1A1KMT2A | |
| SCHEMBL7229876 | 0.78 | PKM (0.47) | MCHR1CYP1A2TSHRALDH1A1LMNA | |
| SCHEMBL7228433 | 0.78 | BCL2L1 (0.41) | MCHR1LTA4HALDH1A1LMNAHPGD | |
| SCHEMBL7221674 | 0.73 | BCL2L1 (0.39) | MCHR1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7222878 | 0.71 | SMN1; SMN2 (0.46) | LTA4HHTTHRH3KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL7221116 | 0.71 | NPBWR1 (0.37) | MCHR1SIGMAR1ALDH1A1LMNAHPGD | |
| SCHEMBL4310506 | 0.70 | CYP2D6 (0.60) | MCHR1CYP1A2LTA4HCYP2D6CYP2C9 | |
| SCHEMBL19644202 | 0.69 | MCHR1 (0.56) | MCHR1CYP1A2LTA4HCYP2D6CYP2C9 | |
| SCHEMBL19642744 | 0.69 | MCHR1 (0.56) | MCHR1CYP1A2LTA4HCYP2D6CYP2C9 |
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-6610705-B1 | Treating breast cancer, osteoporosis, hypercholesteremia or endometriosis | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2003-08-26 | — | — | US | claimed |
| US-6610705-B1 | Treating breast cancer, osteoporosis, hypercholesteremia or endometriosis | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2003-08-26 | — | — | US | disclosed |