Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL9634196 | 0.90 | ALDH1A1 (0.57) | ALDH1A1CYP3A4KMT2AMEN1LMNA | |
| SCHEMBL10634281 | 0.89 | CYP3A4 (0.48) | ALDH1A1CYP3A4KMT2AMEN1TDP1 | |
| SCHEMBL10631803 | 0.89 | CYP3A4 (0.48) | ALDH1A1CYP3A4KMT2AMEN1TDP1 | |
| SCHEMBL10392892 | 0.89 | ALDH1A1 (0.61) | ALDH1A1CYP3A4KMT2AMEN1LMNA | |
| SCHEMBL10368324 | 0.89 | CYP3A4 (0.50) | ALDH1A1CYP3A4KMT2AMEN1LMNA | |
| SCHEMBL6522972 | 0.89 | ALDH1A1 (0.50) | ALDH1A1CYP3A4KMT2AMEN1TDP1 | |
| SCHEMBL10628607 | 0.88 | ALDH1A1 (0.47) | ALDH1A1CYP3A4KMT2AMEN1TDP1 | |
| SCHEMBL1286480 | 0.88 | ALDH1A1 (0.60) | ALDH1A1CYP3A4KMT2AMEN1LMNA | |
| SCHEMBL10508453 | 0.86 | KMT2A (0.46) | ALDH1A1CYP3A4KMT2AMEN1TDP1 | |
| SCHEMBL10506107 | 0.86 | KMT2A (0.46) | ALDH1A1CYP3A4KMT2AMEN1TDP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4897107-A | PLANT GROWTH REGULATORS; FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1990-01-30 | — | — | US | claimed |
| EP-0141204-B1 | HYDROXYETHYL AZOLE DERIVATIVES | BAYER AG (DE) | 1990-05-02 | — | — | EP | disclosed |
| US-4843088-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-06-27 | — | — | US | disclosed |
| US-4645767-A | FOR PLANTS | BAYER AKTIENGESELLSCHAFT (DE) | 1987-02-24 | — | — | US | disclosed |
| EP-0141204-A2 | Hydroxyethyl azole derivatives | BAYER AG (DE) | 1985-05-15 | — | — | EP | disclosed |