Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.35 |
| ▸ | TUBB | P07437 | 3/20 | 0.35 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.35 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.35 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.35 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.35 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.35 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.35 |
| ▸ | TUBB8 | Q3ZCM7 | 3/20 | 0.35 |
| ▸ | TUBA3E | Q6PEY2 | 3/20 | 0.35 |
| ▸ | TUBA1A | Q71U36 | 3/20 | 0.35 |
| ▸ | TUBA1C | Q9BQE3 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19005997 | 0.90 | SIGMAR1 (0.34) | CYP3A4CYP1A2MEN1KMT2AKCNH2 | |
| SCHEMBL19005966 | 0.90 | CYP3A4 (0.38) | CYP3A4CYP1A2TSHRNFKB1MEN1 | |
| SCHEMBL18987263 | 0.90 | KCNH2 (0.34) | KCNH2TMEM97SIGMAR1 | |
| SCHEMBL19005915 | 0.83 | PDE4A (0.33) | TSHRLMNAADRB2 | |
| SCHEMBL19005969 | 0.81 | CYP19A1 (0.45) | CYP3A4CYP1A2TSHRNFKB1MEN1 | |
| SCHEMBL18987234 | 0.80 | PPARG (0.32) | TSHRLMNA | |
| SCHEMBL18988796 | 0.78 | CYP3A4 (0.36) | CYP3A4CYP1A2TSHRNFKB1MEN1 | |
| SCHEMBL19005987 | 0.77 | HDAC1 (0.38) | CYP3A4CYP1A2TSHRMEN1KMT2A | |
| SCHEMBL19005967 | 0.72 | GAA (0.36) | MEN1KMT2AGAA | |
| SCHEMBL997147 | 0.71 | TUBB1 (0.48) | CYP1A2MEN1LMNAKMT2ATUBB4A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017103637-A1 | DIPHENYLPROPANE COMPOUNDS AND THEIR CYTOTOXIC ACTIVITY | BLIRT S.A. (PL) | 2017-06-22 | — | — | WO | disclosed |