Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
| ▸ | MAT2A | P31153 | 4/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28072594 | 0.79 | TRPV1 (0.36) | ALOX15 | |
| SCHEMBL6450175 | 0.77 | HTR2C (0.38) | ALDH1A1KMT2A | |
| SCHEMBL8835486 | 0.72 | NQO1 (0.39) | CHRNB2CHRNA4ABL1ALDH1A1TSHR | |
| SCHEMBL9093780 | 0.72 | LTA4H (0.41) | TSHR | |
| SCHEMBL1067722 | 0.72 | ALOX15 (0.39) | ALDH1A1TSHRPOLBKMT2AATM | |
| SCHEMBL900731 | 0.72 | ALOX15 (0.35) | ALDH1A1TSHRPOLBKMT2AATM | |
| SCHEMBL900568 | 0.72 | ALOX15 (0.35) | ALDH1A1TSHRKMT2AATMALOX15 | |
| SCHEMBL1067134 | 0.71 | ALOX15 (0.34) | ALDH1A1TSHRPOLBKMT2AALOX15 | |
| SCHEMBL401985 | 0.71 | KMT2A (0.36) | ALDH1A1TSHRPOLBKMT2AATM | |
| SCHEMBL1067511 | 0.71 | ALOX15 (0.34) | ALDH1A1TSHRKMT2AATMALOX15 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105308053-A | Spiroindoline derivatives useful as gonadotropin releasing hormone receptor antagonists | Bayer Pharma AG | 2016-02-03 | — | — | CN | disclosed |