Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.41 |
| ▸ | LMNA | P02545 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | IDO1 | P14902 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.40 |
| ▸ | FYN | P06241 | 2/20 | 0.40 |
| ▸ | PGR | P06401 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL13667442 | 1.00 | CYP2C9 (0.41) | CYP2C9CYP3A4LMNACYP1A2CYP2D6 | |
| SCHEMBL4306832 | 1.00 | CYP2C9 (0.41) | CYP2C9CYP3A4LMNACYP1A2CYP2D6 | |
| SCHEMBL4309837 | 0.90 | AVPR2 (0.35) | LMNAMEN1KMT2AADRA2CHTT | |
| SCHEMBL13667434 | 0.85 | POLB (0.37) | CYP2C9CYP3A4LMNACYP1A2CYP2D6 | |
| SCHEMBL13667440 | 0.85 | POLB (0.37) | CYP2C9CYP3A4LMNACYP1A2CYP2D6 | |
| SCHEMBL4311461 | 0.85 | POLB (0.37) | CYP2C9CYP3A4LMNACYP1A2CYP2D6 | |
| SCHEMBL4312053 | 0.84 | AVPR2 (0.42) | OPRM1 | |
| SCHEMBL13667367 | 0.84 | AVPR2 (0.42) | OPRM1 | |
| SCHEMBL13667366 | 0.84 | AVPR2 (0.42) | OPRM1 | |
| SCHEMBL13667412 | 0.81 | CYP1A2 (0.38) | CYP2C9CYP3A4LMNACYP1A2CYP2D6 |
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-7598279-B2 | Neurotherapeutic azole compounds | SK HOLDINGS CO., LTD. (KR) | 2009-10-06 | — | — | US | disclosed |
| US-7598279-B2 | Neurotherapeutic azole compounds | SK HOLDINGS CO., LTD. (KR) | 2009-10-06 | — | — | US | disclosed |