Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.79 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | HTR6 | P50406 | 2/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.51 |
| ▸ | YES1 | P07947 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | JAK3 | P52333 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8415790 | 0.92 | HTR2C (0.67) | HTR2CPOLBHTR6CYP19A1YES1 | |
| SCHEMBL26391933 | 0.88 | HTR2C (1.00) | HTR2CPOLBHTR6CYP19A1CHRM1 | |
| SCHEMBL8416389 | 0.87 | HTR2C (0.59) | HTR2CPOLBHTR6CYP19A1YES1 | |
| Fumaric Acid SCHEMBL8416954 | 0.86 | HTR2C (0.60) | HTR2CPOLBCYP19A1YES1KDR | |
| Maleic Acid SCHEMBL8416947 | 0.86 | HTR2C (0.60) | HTR2CPOLBCYP19A1YES1KDR | |
| SCHEMBL8415599 | 0.86 | HTR2C (0.65) | HTR2CPOLBHTR6CYP19A1YES1 | |
| SCHEMBL9054478 | 0.81 | YES1 (0.68) | HTR2CPOLBYES1KDRJAK3 | |
| SCHEMBL9056570 | 0.81 | HTR2C (0.51) | HTR2CHTR6LMNAKMT2A | |
| SCHEMBL9055307 | 0.79 | YES1 (0.69) | HTR2CPOLBHTR6CYP19A1YES1 | |
| SCHEMBL8418190 | 0.79 | CYP19A1 (0.58) | HTR2CPOLBHTR6CYP19A1YES1 |
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-1996004266-A2 | INDOL, INDAZOL, PYRIDOPYRROL AND PYRIDOPYRAZOL DERIVATIVES WITH ANTI-ASTHMATIC, ANTI-ALLERGIC, ANTI-INFLAMMATORY AND IMMUNOMODULATING EFFECTS | ASTA MEDICA AKTIENGESELLSCHAFT (DE) | 1996-02-15 | — | — | WO | disclosed |