Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL11245620 | 0.85 | PTPN1 (0.58) | PTPN1HSD17B1HSD17B2MEN1KMT2A | |
| SCHEMBL11928334 | 0.81 | PLK1 (0.48) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL11222790 | 0.76 | HSD17B1 (0.39) | HSD17B1HSD17B2KDM4EMEN1KMT2A | |
| SCHEMBL11400947 | 0.73 | MAOB (0.41) | HSD17B1HSD17B2KDM4EMEN1KMT2A | |
| SCHEMBL7822715 | 0.72 | HSD17B1 (0.42) | HSD17B1HSD17B2KDM4EMEN1KMT2A | |
| SCHEMBL7822719 | 0.72 | CYP1A2 (0.57) | HSD17B1HSD17B2KDM4EALDH1A1HPGD | |
| SCHEMBL29950999 | 0.71 | MGLL (0.49) | HSD17B1HSD17B2KDM4EMEN1KMT2A | |
| Fluoride SCHEMBL11230601 | 0.71 | CASP6 (0.50) | HSD17B1HSD17B2KDM4EMEN1KMT2A | |
| SCHEMBL8344284 | 0.70 | CES2 (0.68) | PTPN1KDM4EMEN1KMT2AHDAC3 | |
| SCHEMBL11230597 | 0.70 | KAT6A (0.40) | HSD17B1HSD17B2KDM4EMEN1KMT2A |
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-4331613-A | Process for the preparation of trifluoromethylnaphthalenes | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-25 | — | — | US | disclosed |