Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 4/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10443875 | 0.80 | HDAC3 (0.41) | HDAC4HDAC7HDAC5MEN1KMT2A | |
| SCHEMBL6964334 | 0.79 | LMNA (0.58) | CYP3A4MEN1KMT2ASLC6A4CYP2D6 | |
| SCHEMBL8905621 | 0.79 | LMNA (0.58) | CYP3A4MEN1KMT2ASLC6A4CYP2D6 | |
| SCHEMBL13049312 | 0.79 | LMNA (0.58) | CYP3A4MEN1KMT2ASLC6A4CYP2D6 | |
| SCHEMBL9281351 | 0.78 | BRD4 (0.44) | BRD4CNR1HDAC4HDAC7HDAC5 | |
| SCHEMBL10001183 | 0.77 | CES2 (0.61) | LMNA | |
| SCHEMBL12437309 | 0.77 | FFAR2 (0.59) | FFAR2MEN1KMT2ALMNA | |
| SCHEMBL9278918 | 0.77 | NPSR1 (0.56) | TSHRALOX15MEN1KMT2AALDH1A1 | |
| SCHEMBL13170113 | 0.77 | BRD4 (0.61) | BRD4CNR1HDAC4HDAC7HDAC5 | |
| SCHEMBL8908400 | 0.76 | ALDH1A1 (0.44) | BRD4CNR1HDAC4HDAC7HDAC5 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5405860-A | Fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1995-04-11 | — | — | US | disclosed |
| EP-0379081-A2 | Process for the preparation of 1-hydroxymethyl oxiranes Z-substituted in position 2 | BASF Aktiengesellschaft (DE) | 1990-07-25 | — | — | EP | disclosed |
| US-4912122-A | Triazolyl alkanones or triazolyl-alkanols | BAYER AKTIENGESELLSCHAFT (DE) | 1990-03-27 | — | — | US | disclosed |
| US-4776877-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1988-10-11 | — | — | US | disclosed |
| US-4772623-A | FUNGICIDES, MICROBIOCIDES, PLANT GROWTH REGULATORS | BAYER AKTIENGESELLSCHAFT (DE) | 1988-09-20 | — | — | US | disclosed |
| US-4582843-A | FUNGICIDES, MICROBIOCIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1986-04-15 | — | — | US | disclosed |