Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL680098 | 0.76 | TDP1 (0.54) | TDP1NPC1RAB9AHPGDALDH1A1 | |
| SCHEMBL10431545 | 0.76 | TDP1 (0.54) | TDP1NPC1RAB9AHPGDALDH1A1 | |
| SCHEMBL523575 | 0.75 | TDP1 (0.43) | TDP1KMT2ACYP2C9CYP2C19CYP2D6 | |
| SCHEMBL11414972 | 0.75 | SIGMAR1 (0.43) | TDP1KMT2ACYP2C9CYP2C19CYP2D6 | |
| SCHEMBL9622333 | 0.75 | TDP1 (0.59) | TDP1NPC1RAB9ATSHRHPGD | |
| SCHEMBL9622329 | 0.75 | TDP1 (0.59) | TDP1NPC1RAB9ATSHRHPGD | |
| SCHEMBL9622811 | 0.75 | TDP1 (0.59) | TDP1NPC1RAB9ATSHRHPGD | |
| SCHEMBL5805322 | 0.72 | TDP1 (0.50) | TDP1NPC1RAB9AHPGDALDH1A1 | |
| SCHEMBL283951 | 0.72 | TDP1 (0.40) | TDP1KMT2ACYP2C9CYP2C19CYP2D6 | |
| SCHEMBL8384621 | 0.71 | TDP1 (0.48) | TDP1HPGDALDH1A1 |
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-2006069096-A1 | SILANOL DERIVATIVES AS INHIBITORS OF HISTONE DEACETYLASE | PHARMACYCLICS, INC. (US) | 2006-06-29 | — | — | WO | disclosed |