Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11896187 | 0.81 | CYP3A4 (0.48) | ALDH1A1CYP3A4TDP1TSHRKMT2A | |
| SCHEMBL13064171 | 0.79 | CA12 (0.42) | ALDH1A1CYP3A4TDP1MAPK1HSD17B10 | |
| SCHEMBL20367154 | 0.79 | ALDH1A1 (0.45) | ALDH1A1CYP3A4KMT2AMEN1L3MBTL1 | |
| SCHEMBL9009465 | 0.79 | GAA (0.33) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL11529316 | 0.78 | CYP3A4 (0.48) | ALDH1A1CYP3A4TDP1TSHRKMT2A | |
| SCHEMBL3480543 | 0.77 | DDR1 (0.41) | ALDH1A1CYP3A4KDM4EPOLB | |
| SCHEMBL11528651 | 0.75 | AAK1 (0.50) | AAK1ALDH1A1CYP3A4TDP1TSHR | |
| SCHEMBL8036085 | 0.74 | ALDH1A1 (0.57) | ALDH1A1TSHRKMT2AMEN1HSD17B10 | |
| SCHEMBL1014289 | 0.73 | MAPT (0.54) | ALDH1A1CYP3A4TDP1TSHRKMT2A | |
| Hydrochloric Acid SCHEMBL19896479 | 0.71 | MAPT (0.52) | ALDH1A1CYP3A4TDP1TSHRKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4146688-A | CHAIN EXTENSION | BAYER AKTIENGESELLSCHAFT (DE) | 1979-03-27 | — | — | US | disclosed |