Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 7/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.32 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.30 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18477663 | 0.86 | HTR2C (0.38) | HTR2CHTR2AHTR2BMEN1ALDH1A1 | |
| SCHEMBL15451802 | 0.79 | HTR2C (0.40) | HTR2CHTR2AHTR2BTRPA1ATM | |
| SCHEMBL15933356 | 0.79 | HTR2C (0.40) | HTR2CHTR2AHTR2BTRPA1ATM | |
| SCHEMBL114449 | 0.75 | HTR2C (0.46) | HTR2CHTR2AHTR2BTRPA1ATM | |
| SCHEMBL28239632 | 0.71 | SMN1; SMN2 (0.38) | HTR2CHTR2AHTR2BMEN1ALDH1A1 | |
| SCHEMBL22086312 | 0.71 | CYP3A4 (0.35) | MEN1ALDH1A1KMT2A | |
| SCHEMBL18656142 | 0.68 | CYP3A4 (0.39) | HTR2CHTR2AHTR2BMEN1KMT2A | |
| SCHEMBL3429458 | 0.67 | CYP11B2 (0.39) | MEN1ALDH1A1KMT2ACYP2A6 | |
| SCHEMBL25060064 | 0.66 | PBRM1 (0.34) | ALDH1A1PBRM1 | |
| SCHEMBL28036409 | 0.66 | CYP2C19 (0.42) | HTR2CMEN1KMT2ACYP1A2CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3992200-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING ORGANOMETALLIC COMPOUND | Samsung Electronics Co., Ltd. (KR) | 2022-05-04 | — | — | EP | disclosed |