Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | RAB9A | P51151 | 1/20 | 0.65 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.64 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | CTSK | P43235 | 3/20 | 0.59 |
| ▸ | CTSL | P07711 | 2/20 | 0.59 |
| ▸ | CTSS | P25774 | 2/20 | 0.59 |
| ▸ | CTSB | P07858 | 1/20 | 0.59 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | TACR1 | P25103 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | ELANE | P08246 | 1/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL13534727 | 1.00 | NPC1 (0.65) | NPC1RAB9ACTRB1ATMCTSK | |
| SCHEMBL9707035 | 0.94 | CTRB1 (0.58) | NPC1RAB9ACTRB1ATMCTSK | |
| SCHEMBL9782114 | 0.94 | CTRB1 (0.58) | NPC1RAB9ACTRB1ATMCTSK | |
| SCHEMBL13884452 | 0.93 | CTRB1 (0.57) | NPC1RAB9ACTRB1ATMCTSK | |
| SCHEMBL14884509 | 0.93 | CTRB1 (0.57) | NPC1RAB9ACTRB1ATMCTSK | |
| Cyclopentane SCHEMBL8925976 | 0.93 | CTRB1 (0.57) | NPC1RAB9ACTRB1ATMCTSK | |
| SCHEMBL15082424 | 0.92 | CTRB1 (0.56) | NPC1RAB9ACTRB1ATMCTSK | |
| SCHEMBL10305326 | 0.92 | CTRB1 (0.56) | NPC1RAB9ACTRB1ATMCTSK | |
| SCHEMBL12193558 | 0.92 | NPC1 (0.63) | NPC1RAB9ACTRB1ATMCTSK | |
| SCHEMBL29137641 | 0.90 | ATM (0.65) | NPC1RAB9ACTRB1ATMCTSK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1592436-A4 | COMPOUNDS THAT BIND P2Y sb 2 /sb OR P2Y sb 1 /sb RECEPTORS | KIMBERLY CLARK CO (US) | 2009-09-02 | — | — | EP | claimed |
| EP-1592436-A2 | COMPOUNDS THAT BIND P2Y sb 2 /sb OR P2Y sb 1 /sb RECEPTORS | Kimberly-Clark Worldwide, Inc. (US) | 2005-11-09 | — | — | EP | claimed |
| WO-2004060907-A2 | COMPOUNDS THAT BIND P2Y2 OR P2Y1 RECEPTORS | KIMBERLY-CLARK WORLDWIDE, INC. (US) | 2004-07-22 | — | — | WO | claimed |