Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 8/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.50 |
| ▸ | USP2 | O75604 | 6/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | HRH1 | P35367 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | TACR2 | P21452 | 2/20 | 0.50 |
| ▸ | TACR1 | P25103 | 2/20 | 0.50 |
| ▸ | EED | O75530 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | SSTR5 | P35346 | 2/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MLNR | O43193 | 1/20 | 0.50 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | HLA-A | P04439 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9564844 | 0.78 | CYP1A2 (0.50) | CYP1A2CYP3A4CYP2C19USP2LMNA | |
| Fumaric Acid SCHEMBL9876528 | 0.77 | HRH1 (0.49) | CYP1A2CYP3A4CYP2C19USP2LMNA | |
| Hydrochloric Acid SCHEMBL11470684 | 0.75 | SSTR5 (0.65) | CYP1A2CYP3A4CYP2C19USP2LMNA | |
| SCHEMBL9564763 | 0.71 | CYP1A2 (0.54) | CYP1A2CYP3A4CYP2C19USP2LMNA | |
| SCHEMBL9564878 | 0.71 | HRH1 (0.49) | CYP1A2CYP3A4CYP2C19USP2LMNA | |
| SCHEMBL10547773 | 0.71 | HTR1A (0.56) | CYP1A2CYP3A4CYP2C19USP2LMNA | |
| SCHEMBL1151577 | 0.70 | KCNH2 (0.80) | CYP1A2CYP3A4CYP2C19USP2LMNA | |
| SCHEMBL9565053 | 0.69 | KCNH2 (0.57) | CYP1A2CYP3A4CYP2C19USP2LMNA | |
| SCHEMBL11482399 | 0.68 | HRH1 (0.58) | CYP1A2CYP3A4CYP2C19USP2LMNA | |
| SCHEMBL10428778 | 0.68 | KCNH2 (0.80) | CYP1A2CYP3A4CYP2C19USP2LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5258380-A | Antiallergens, antihistamines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-11-02 | — | — | US | disclosed |
| US-5041448-A | Antiallergens | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-08-20 | — | — | US | disclosed |
| EP-0206415-A2 | (4-Piperidinylmethyl and -hetero)purines | JANSSEN PHARMACEUTICA N.V. (BE) | 1986-12-30 | — | — | EP | disclosed |