Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | CETP | P11597 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL706601 | 0.88 | TSHR (0.62) | ALDH1A1TSHRHSD17B10CETPCYP1A2 | |
| SCHEMBL7980644 | 0.86 | KIF11 (0.45) | ALDH1A1TSHRHSD17B10KIF11CETP | |
| SCHEMBL11679555 | 0.86 | ALDH1A1 (0.69) | ALDH1A1TSHRHSD17B10KDM4EMEN1 | |
| SCHEMBL7914123 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TSHRHSD17B10CETPKDM4E | |
| SCHEMBL1361753 | 0.77 | ALDH1A1 (0.59) | ALDH1A1TSHRHSD17B10KIF11CETP | |
| SCHEMBL6601005 | 0.77 | ALDH1A1 (0.59) | ALDH1A1TSHRHSD17B10CA1CA2 | |
| SCHEMBL7911156 | 0.76 | ALDH1A1 (0.47) | ALDH1A1TSHRHSD17B10CETPKDM4E | |
| SCHEMBL7911934 | 0.76 | ALDH1A1 (0.47) | ALDH1A1TSHRHSD17B10CETPKDM4E | |
| SCHEMBL306823 | 0.76 | KIF11 (0.50) | KIF11HDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL18293362 | 0.76 | KIF11 (0.50) | KIF11HDAC1HDAC2HDAC3HDAC4 |
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-6172093-B1 | PESTICIDES, INSECTICIDES, NEMATOCIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2001-01-09 | — | — | US | disclosed |
| US-5969147-A | Substituted biphenyloxazolines | BAYER AKTIENGESELLSCHAFT (DE) | 1999-10-19 | — | — | US | disclosed |