Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | PRKCI | P41743 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20175942 | 0.93 | TSHR (0.59) | TSHRHTR1APRKCIMAPTCYP1A2 | |
| SCHEMBL13051280 | 0.87 | TSHR (0.58) | TSHRHTR1APRKCIMAPTCYP1A2 | |
| SCHEMBL24672899 | 0.87 | TSHR (0.44) | TSHRHTR1APRKCIMAPTCYP1A2 | |
| SCHEMBL18197359 | 0.86 | TSHR (0.53) | TSHRHTR1APRKCIMAPTCYP1A2 | |
| SCHEMBL15483822 | 0.86 | HTR1A (0.47) | TSHRHTR1ACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL24672945 | 0.85 | TSHR (0.43) | TSHRHTR1APRKCIMAPTCYP1A2 | |
| SCHEMBL31038835 | 0.85 | PRKCI (0.60) | TSHRHTR1APRKCIMAPTCYP1A2 | |
| SCHEMBL1822448 | 0.85 | PRKCI (0.60) | TSHRHTR1APRKCIMAPTCYP1A2 | |
| SCHEMBL4854148 | 0.85 | PRKCI (0.55) | TSHRHTR1APRKCIMAPTCYP1A2 | |
| SCHEMBL24673207 | 0.83 | TSHR (0.41) | TSHRHTR1APRKCIMAPTCYP1A2 |
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-1994004485-A1 | LIGANDS FOR Ga-68 PET HEART APPLICATIONS | MALLINCKRODT MEDICAL, INC. (US) | 1994-03-03 | — | — | WO | disclosed |